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Undecanedioic Acid

PubChem CID: 15816

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Compound Synonyms UNDECANEDIOIC ACID, 1852-04-6, 1,9-Nonanedicarboxylic acid, 1,9-Nonanedicarboxylicacid, 1,11-Undecanedioic acid, Hendecanedioic acid, Undecanedionic acid, Undecandioic acid, Hendecanedioate, Undecanedioate, Undecanedionate, UNII-7059GFK8NV, 7059GFK8NV, DTXSID0044862, 1,11-Undecanedioate, CHEBI:73713, 1,9-Nonanedicarboxylate, EINECS 217-440-6, MFCD00004444, NSC 400241, NSC-400241, DTXCID8024862, EC 217-440-6, NSC400241, 1052-04-6, Undecandioic acid, 1,11-Undecanedioic acid, Nonamethylenedicarboxylic Acid, 1,9-Nonanedicarboxylic Acid, Hendecanedioic Acid, NSC 400241, undecandisäure, Undecanedioic acid, 97%, bmse000847, bmse000880, Undecane-1,11-dioic acid, SCHEMBL28401, CHEMBL3183300, Tox21_300954, LMFA01170007, s6333, AKOS015919038, CS-W014841, HY-W014125, NCGC00248227-01, NCGC00254856-01, AS-14889, SY051603, CAS-1852-04-6, N0333, NS00002110, Undecanedioic acid, puriss., >=99.0% (GC), EN300-1212389, Q27144063, Z1508914846, 217-440-6, 806-507-0
Topological Polar Surface Area 74.6
Hydrogen Bond Donor Count 2.0
Heavy Atom Count 15.0
Description Undecanedioic acid has been found in parts of human aortas with advanced atherosclerotic lesions associated with intercellular matrix macromolecules and specifically with elastin, and may be the result of an increased hydrolysis of esters and (or) a decreased esterification. (PMID: 131675) Undecanedioic acid has been found (among other unusual dicarboxylic acids) in the urine from patients under hopantenate therapy during episodes of Reye's-like syndrome. (PMID: 2331533) [HMDB]
Isotope Atom Count 0.0
Molecular Complexity 169.0
Database Name cmaup_ingredients;fooddb_chem_all;hmdb_chem_all;npass_chem_all;pubchem
Defined Atom Stereocenter Count 0.0
Uniprot Id P10275
Iupac Name undecanedioic acid
Prediction Hob 1.0
Class Fatty Acyls
Xlogp 2.7
Superclass Lipids and lipid-like molecules
Subclass Fatty acids and conjugates
Molecular Formula C11H20O4
Prediction Swissadme 0.0
Inchi Key LWBHHRRTOZQPDM-UHFFFAOYSA-N
Fcsp3 0.8181818181818182
Logs -2.554
Rotatable Bond Count 10.0
State Solid
Logd 3.943
Synonyms 1,11-Undecanedioate, 1,11-Undecanedioic acid, 1,9-Nonanedicarboxylate, 1,9-Nonanedicarboxylic acid, Hendecanedioate, Hendecanedioic acid, Undecanedioate, Undecanedioic acid, Undecanedionate, Undecanedionic acid
Substituent Name Medium-chain fatty acid, Dicarboxylic acid or derivatives, Carboxylic acid, Carboxylic acid derivative, Hydrocarbon derivative, Organooxygen compound, Carbonyl group, Aliphatic acyclic compound
Compound Name Undecanedioic Acid
Kingdom Organic compounds
Prediction Hob Swissadme 0.0
Exact Mass 216.136
Formal Charge 0.0
Monoisotopic Mass 216.136
Hydrogen Bond Acceptor Count 4.0
Molecular Weight 216.27
Covalent Unit Count 1.0
Total Atom Stereocenter Count 0.0
Total Bond Stereocenter Count 0.0
Molecular Framework Aliphatic acyclic compounds
Esol -2.1904173999999994
Inchi InChI=1S/C11H20O4/c12-10(13)8-6-4-2-1-3-5-7-9-11(14)15/h1-9H2,(H,12,13)(H,14,15)
Smiles C(CCCCC(=O)O)CCCCC(=O)O
Nring 0.0
Defined Bond Stereocenter Count 0.0
Taxonomy Direct Parent Medium-chain fatty acids

  • 1. Outgoing r'ship FOUND_IN to/from Aconitum Ferox (Plant) Rel Props:Reference:
  • 2. Outgoing r'ship FOUND_IN to/from Actaea Spicata (Plant) Rel Props:Reference:
  • 3. Outgoing r'ship FOUND_IN to/from Aloe (Plant) Rel Props:Reference:
  • 4. Outgoing r'ship FOUND_IN to/from Aloe Abyssinica (Plant) Rel Props:Reference:
  • 5. Outgoing r'ship FOUND_IN to/from Aloe Africana (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 6. Outgoing r'ship FOUND_IN to/from Aloe Arborescens (Plant) Rel Props:Reference:
  • 7. Outgoing r'ship FOUND_IN to/from Aloe Ballyi (Plant) Rel Props:Reference:
  • 8. Outgoing r'ship FOUND_IN to/from Aloe Barbadensis (Plant) Rel Props:Source_db:npass_chem_all
  • 9. Outgoing r'ship FOUND_IN to/from Aloe Christianii (Plant) Rel Props:Reference:
  • 10. Outgoing r'ship FOUND_IN to/from Aloe Deltoideodonta (Plant) Rel Props:Reference:
  • 11. Outgoing r'ship FOUND_IN to/from Aloe Ferox (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 12. Outgoing r'ship FOUND_IN to/from Aloe Indica (Plant) Rel Props:Reference:
  • 13. Outgoing r'ship FOUND_IN to/from Aloe Littoralis (Plant) Rel Props:Reference:
  • 14. Outgoing r'ship FOUND_IN to/from Aloe Marlothii (Plant) Rel Props:Reference:
  • 15. Outgoing r'ship FOUND_IN to/from Aloe Microstigma (Plant) Rel Props:Reference:
  • 16. Outgoing r'ship FOUND_IN to/from Aloe Nobilis (Plant) Rel Props:Reference:
  • 17. Outgoing r'ship FOUND_IN to/from Aloe Perryi (Plant) Rel Props:Reference:
  • 18. Outgoing r'ship FOUND_IN to/from Aloe Ruspoliana (Plant) Rel Props:Reference:
  • 19. Outgoing r'ship FOUND_IN to/from Aloe Saponaria (Plant) Rel Props:Reference:
  • 20. Outgoing r'ship FOUND_IN to/from Aloe Socotrina (Plant) Rel Props:Reference:
  • 21. Outgoing r'ship FOUND_IN to/from Aloe Spicata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 22. Outgoing r'ship FOUND_IN to/from Aloe Succotrina (Plant) Rel Props:Reference:
  • 23. Outgoing r'ship FOUND_IN to/from Aloe Vera (Plant) Rel Props:Source_db:cmaup_ingredients
  • 24. Outgoing r'ship FOUND_IN to/from Aloe Vulgaris (Plant) Rel Props:Reference:
  • 25. Outgoing r'ship FOUND_IN to/from Amphorogyne Spicata (Plant) Rel Props:Reference:
  • 26. Outgoing r'ship FOUND_IN to/from Anogeissus Sericea (Plant) Rel Props:Reference:
  • 27. Outgoing r'ship FOUND_IN to/from Anthyllis Onobrychoides (Plant) Rel Props:Reference:
  • 28. Outgoing r'ship FOUND_IN to/from Antiaris Africana (Plant) Rel Props:Reference:
  • 29. Outgoing r'ship FOUND_IN to/from Argyreia Sericea (Plant) Rel Props:Reference:
  • 30. Outgoing r'ship FOUND_IN to/from Austrotaxus Spicata (Plant) Rel Props:Reference:
  • 31. Outgoing r'ship FOUND_IN to/from Canavalia Africana (Plant) Rel Props:Reference:
  • 32. Outgoing r'ship FOUND_IN to/from Catananche Caerulea (Plant) Rel Props:Reference:
  • 33. Outgoing r'ship FOUND_IN to/from Cautleya Spicata (Plant) Rel Props:Reference:
  • 34. Outgoing r'ship FOUND_IN to/from Cynanchum Auriculatum (Plant) Rel Props:Reference:
  • 35. Outgoing r'ship FOUND_IN to/from Cyphostemma Auriculatum (Plant) Rel Props:Reference:
  • 36. Outgoing r'ship FOUND_IN to/from Dalbergia Sericea (Plant) Rel Props:Reference:
  • 37. Outgoing r'ship FOUND_IN to/from Datura Ferox (Plant) Rel Props:Reference:
  • 38. Outgoing r'ship FOUND_IN to/from Engelhardtia Spicata (Plant) Rel Props:Reference:
  • 39. Outgoing r'ship FOUND_IN to/from Entada Africana (Plant) Rel Props:Reference:
  • 40. Outgoing r'ship FOUND_IN to/from Eumorphia Sericea (Plant) Rel Props:Reference:
  • 41. Outgoing r'ship FOUND_IN to/from Euryale Ferox (Plant) Rel Props:Reference:
  • 42. Outgoing r'ship FOUND_IN to/from Ferula Alliacea (Plant) Rel Props:Reference:
  • 43. Outgoing r'ship FOUND_IN to/from Ferula Ammoniacum (Plant) Rel Props:Reference:
  • 44. Outgoing r'ship FOUND_IN to/from Ferula Arrigonii (Plant) Rel Props:Reference:
  • 45. Outgoing r'ship FOUND_IN to/from Ferula Asafoetida (Plant) Rel Props:Reference:
  • 46. Outgoing r'ship FOUND_IN to/from Ferula Assafoetida (Plant) Rel Props:Reference:
  • 47. Outgoing r'ship FOUND_IN to/from Ferula Borealis (Plant) Rel Props:Reference:
  • 48. Outgoing r'ship FOUND_IN to/from Ferula Foetida (Plant) Rel Props:Reference:
  • 49. Outgoing r'ship FOUND_IN to/from Ferula Fukanensis (Plant) Rel Props:Reference:
  • 50. Outgoing r'ship FOUND_IN to/from Ferula Galbaniflua (Plant) Rel Props:Source_db:npass_chem_all
  • 51. Outgoing r'ship FOUND_IN to/from Ferula Gummosa (Plant) Rel Props:Reference:
  • 52. Outgoing r'ship FOUND_IN to/from Ferula Jaeschkeana (Plant) Rel Props:Reference:
  • 53. Outgoing r'ship FOUND_IN to/from Ferula Kuhistanica (Plant) Rel Props:Reference:
  • 54. Outgoing r'ship FOUND_IN to/from Ferula Moschata (Plant) Rel Props:Reference:
  • 55. Outgoing r'ship FOUND_IN to/from Ferula Narther (Plant) Rel Props:Reference:
  • 56. Outgoing r'ship FOUND_IN to/from Ferula Narthex (Plant) Rel Props:Reference:
  • 57. Outgoing r'ship FOUND_IN to/from Ferula Oopoda (Plant) Rel Props:Reference:
  • 58. Outgoing r'ship FOUND_IN to/from Ferula Ovina (Plant) Rel Props:Reference:
  • 59. Outgoing r'ship FOUND_IN to/from Ferula Persica (Plant) Rel Props:Reference:
  • 60. Outgoing r'ship FOUND_IN to/from Ferula Polyantha (Plant) Rel Props:Reference:
  • 61. Outgoing r'ship FOUND_IN to/from Ferula Transiliensis (Plant) Rel Props:Reference:
  • 62. Outgoing r'ship FOUND_IN to/from Galenia Africana (Plant) Rel Props:Reference:
  • 63. Outgoing r'ship FOUND_IN to/from Garcinia Spicata (Plant) Rel Props:Reference:
  • 64. Outgoing r'ship FOUND_IN to/from Gentiana Spicata (Plant) Rel Props:Reference:
  • 65. Outgoing r'ship FOUND_IN to/from Indigofera Caerulea (Plant) Rel Props:Reference:
  • 66. Outgoing r'ship FOUND_IN to/from Indigofera Spicata (Plant) Rel Props:Reference:
  • 67. Outgoing r'ship FOUND_IN to/from Jasminum Auriculatum (Plant) Rel Props:Reference:
  • 68. Outgoing r'ship FOUND_IN to/from Kigelia Africana (Plant) Rel Props:Reference:
  • 69. Outgoing r'ship FOUND_IN to/from Kiggelaria Africana (Plant) Rel Props:Reference:
  • 70. Outgoing r'ship FOUND_IN to/from Liatris Spicata (Plant) Rel Props:Reference:
  • 71. Outgoing r'ship FOUND_IN to/from Liriope Spicata (Plant) Rel Props:Reference:
  • 72. Outgoing r'ship FOUND_IN to/from Lonicera Angustifolia (Plant) Rel Props:Reference:
  • 73. Outgoing r'ship FOUND_IN to/from Lonicera Bournei (Plant) Rel Props:Reference:
  • 74. Outgoing r'ship FOUND_IN to/from Lonicera Caerulea (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
  • 75. Outgoing r'ship FOUND_IN to/from Lonicera Confusa (Plant) Rel Props:Reference:
  • 76. Outgoing r'ship FOUND_IN to/from Lonicera Confuse (Plant) Rel Props:Reference:
  • 77. Outgoing r'ship FOUND_IN to/from Lonicera Dasystyla (Plant) Rel Props:Reference:
  • 78. Outgoing r'ship FOUND_IN to/from Lonicera Fulvotomentosa (Plant) Rel Props:Reference:
  • 79. Outgoing r'ship FOUND_IN to/from Lonicera Hypoglauca (Plant) Rel Props:Reference:
  • 80. Outgoing r'ship FOUND_IN to/from Lonicera Hypoleuca (Plant) Rel Props:Reference:
  • 81. Outgoing r'ship FOUND_IN to/from Lonicera Implexa (Plant) Rel Props:Reference:
  • 82. Outgoing r'ship FOUND_IN to/from Lonicera Japonica (Plant) Rel Props:Reference:
  • 83. Outgoing r'ship FOUND_IN to/from Lonicera Korolkowii (Plant) Rel Props:Reference:
  • 84. Outgoing r'ship FOUND_IN to/from Lonicera Leschenaultii (Plant) Rel Props:Reference:
  • 85. Outgoing r'ship FOUND_IN to/from Lonicera Macrantha (Plant) Rel Props:Reference:
  • 86. Outgoing r'ship FOUND_IN to/from Lonicera Macranthoides (Plant) Rel Props:Reference:
  • 87. Outgoing r'ship FOUND_IN to/from Lonicera Morrowii (Plant) Rel Props:Reference:
  • 88. Outgoing r'ship FOUND_IN to/from Lonicera Periclymenum (Plant) Rel Props:Reference:
  • 89. Outgoing r'ship FOUND_IN to/from Lonicera Quinquelocularis (Plant) Rel Props:Reference:
  • 90. Outgoing r'ship FOUND_IN to/from Lonicera Similis (Plant) Rel Props:Reference:
  • 91. Outgoing r'ship FOUND_IN to/from Lonicera Spinosa (Plant) Rel Props:Reference:
  • 92. Outgoing r'ship FOUND_IN to/from Lonicera Tatarica (Plant) Rel Props:Reference:
  • 93. Outgoing r'ship FOUND_IN to/from Mammea Africana (Plant) Rel Props:Reference:
  • 94. Outgoing r'ship FOUND_IN to/from Mentha Spicata (Plant) Rel Props:Reference:
  • 95. Outgoing r'ship FOUND_IN to/from Moullava Spicata (Plant) Rel Props:Reference:
  • 96. Outgoing r'ship FOUND_IN to/from Mundulea Sericea (Plant) Rel Props:Reference:
  • 97. Outgoing r'ship FOUND_IN to/from Myrsine Africana (Plant) Rel Props:Reference:
  • 98. Outgoing r'ship FOUND_IN to/from Nauclea Rhynchophylla (Plant) Rel Props:Reference:
  • 99. Outgoing r'ship FOUND_IN to/from Neolitsea Sericea (Plant) Rel Props:Reference:
  • 100. Outgoing r'ship FOUND_IN to/from Nymphaea Caerulea (Plant) Rel Props:Reference:
  • 101. Outgoing r'ship FOUND_IN to/from Osteospermum Fruticosum (Plant) Rel Props:Reference:
  • 102. Outgoing r'ship FOUND_IN to/from Osteospermum Hyoseroides (Plant) Rel Props:Reference:
  • 103. Outgoing r'ship FOUND_IN to/from Osteospermum Muricatum (Plant) Rel Props:Reference:
  • 104. Outgoing r'ship FOUND_IN to/from Passiflora Caerulea (Plant) Rel Props:Reference:
  • 105. Outgoing r'ship FOUND_IN to/from Pluchea Sericea (Plant) Rel Props:Reference:
  • 106. Outgoing r'ship FOUND_IN to/from Prosopis Africana (Plant) Rel Props:Reference:
  • 107. Outgoing r'ship FOUND_IN to/from Prunus Africana (Plant) Rel Props:Reference:
  • 108. Outgoing r'ship FOUND_IN to/from Quassia Africana (Plant) Rel Props:Reference:
  • 109. Outgoing r'ship FOUND_IN to/from Rosa Sericea (Plant) Rel Props:Reference:
  • 110. Outgoing r'ship FOUND_IN to/from Schenkia Spicata (Plant) Rel Props:Reference:
  • 111. Outgoing r'ship FOUND_IN to/from Solanum Ferox (Plant) Rel Props:Reference:
  • 112. Outgoing r'ship FOUND_IN to/from Symplocos Spicata (Plant) Rel Props:Reference:
  • 113. Outgoing r'ship FOUND_IN to/from Thymbra Spicata (Plant) Rel Props:Reference:
  • 114. Outgoing r'ship FOUND_IN to/from Trigonella Caerulea (Plant) Rel Props:Reference:
  • 115. Outgoing r'ship FOUND_IN to/from Uncaria Africana (Plant) Rel Props:Reference:
  • 116. Outgoing r'ship FOUND_IN to/from Uncaria Rhynchophylla (Plant) Rel Props:Reference:
  • 117. Outgoing r'ship FOUND_IN to/from Wagatea Spicata (Plant) Rel Props:Reference: