Torularhodin

PubChem CID: 5281248

Connections displayed (default: 10).

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Compound Synonyms	Torularhodin, 514-92-1, UNII-M6I3U8GW5W, M6I3U8GW5W, TORULARODINE, EINECS 208-189-3, TORULARHODIN [MI], (2E,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-2,6,10,14,19,23-hexamethyl-25-(2,6,6-trimethylcyclohexen-1-yl)pentacosa-2,4,6,8,10,12,14,16,18,20,22,24-dodecaenoic acid, ALL-TRANS-TORULARHODIN, NSC635690, (3'E)-3',4'-Didehydro-beta,psi-caroten-16'-oic acid, .GAMMA.-CAROTEN-16'-OIC ACID, 3',4'-DIDEHYDRO-, .GAMMA.-CAROTEN-16'-OIC ACID, 3',4'-DIDEHYDRO-, ALL-TRANS-, Torularhodine, 3',4'-DIDEHYDRO-.BETA.,.PSI.-CAROTEN-16'-OIC ACID, SCHEMBL114499, CHEMBL1980160, CHEBI:211238, NESPPCWGYRQEJQ-VATUXEBJSA-N, DTXSID901031443, FT57831, NSC-635690, 3',4'-Didehydro-b,?-caroten-16'-oic acid, Q27283559, GAMMA-CAROTEN-16'-OIC ACID, 3',4'-DIDEHYDRO-, beta,psi-Caroten-16'-oic acid, 3',4'-didehydro-, (3'E)-, GAMMA-CAROTEN-16'-OIC ACID, 3',4'-DIDEHYDRO-, ALL-TRANS-, (2E,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-2,6,10,14,19,23-Hexamethyl-25-(2,6,6-trimethylcyclohex-1-en-1-yl)pentacosa-2,4,6,8,10,12,14,16,18,20,22,24-dodecaenoic acid, 208-189-3
Topological Polar Surface Area	37.3
Hydrogen Bond Donor Count	1.0
Heavy Atom Count	42.0
Isotope Atom Count	0.0
Molecular Complexity	1330.0
Database Name	cmaup_ingredients;npass_chem_all;pubchem
Defined Atom Stereocenter Count	0.0
Iupac Name	(2E,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-2,6,10,14,19,23-hexamethyl-25-(2,6,6-trimethylcyclohexen-1-yl)pentacosa-2,4,6,8,10,12,14,16,18,20,22,24-dodecaenoic acid
Prediction Hob	0.0
Xlogp	13.3
Molecular Formula	C40H52O2
Prediction Swissadme	0.0
Inchi Key	NESPPCWGYRQEJQ-VATUXEBJSA-N
Fcsp3	0.325
Logs	-3.988
Rotatable Bond Count	13.0
Logd	4.063
Compound Name	Torularhodin
Prediction Hob Swissadme	0.0
Exact Mass	564.397
Formal Charge	0.0
Monoisotopic Mass	564.397
Hydrogen Bond Acceptor Count	2.0
Molecular Weight	564.8
Covalent Unit Count	1.0
Total Atom Stereocenter Count	0.0
Total Bond Stereocenter Count	12.0
Esol	-10.8441948
Inchi	InChI=1S/C40H52O2/c1-31(19-12-21-33(3)22-13-23-34(4)25-15-26-37(7)39(41)42)17-10-11-18-32(2)20-14-24-35(5)28-29-38-36(6)27-16-30-40(38,8)9/h10-15,17-26,28-29H,16,27,30H2,1-9H3,(H,41,42)/b11-10+,19-12+,20-14+,22-13+,25-15+,29-28+,31-17+,32-18+,33-21+,34-23+,35-24+,37-26+
Smiles	CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C(=O)O)/C)/C
Nring	1.0
Defined Bond Stereocenter Count	12.0

1. Outgoing r'ship FOUND_IN to/from Aerva Sanguinolenta (Plant) Rel Props:Reference:
2. Outgoing r'ship FOUND_IN to/from Cacalia Bicolor (Plant) Rel Props:Reference:
3. Outgoing r'ship FOUND_IN to/from Caladium Bicolor (Plant) Rel Props:Reference:
4. Outgoing r'ship FOUND_IN to/from Campanula Pallida (Plant) Rel Props:Reference:
5. Outgoing r'ship FOUND_IN to/from Christisonia Bicolor (Plant) Rel Props:Reference:
6. Outgoing r'ship FOUND_IN to/from Corydalis Pallida (Plant) Rel Props:Reference:
7. Outgoing r'ship FOUND_IN to/from Crotalaria Pallida (Plant) Rel Props:Reference:
8. Outgoing r'ship FOUND_IN to/from Dichrocephala Bicolor (Plant) Rel Props:Reference:
9. Outgoing r'ship FOUND_IN to/from Echinacea Pallida (Plant) Rel Props:Reference:
10. Outgoing r'ship FOUND_IN to/from Erythrina Abyssinica (Plant) Rel Props:Reference:
11. Outgoing r'ship FOUND_IN to/from Erythrina Americana (Plant) Rel Props:Reference:
12. Outgoing r'ship FOUND_IN to/from Erythrina Arborescens (Plant) Rel Props:Reference:
13. Outgoing r'ship FOUND_IN to/from Erythrina Berteroana (Plant) Rel Props:Reference:
14. Outgoing r'ship FOUND_IN to/from Erythrina Burttii (Plant) Rel Props:Reference:
15. Outgoing r'ship FOUND_IN to/from Erythrina Chiriquensis (Plant) Rel Props:Reference:
16. Outgoing r'ship FOUND_IN to/from Erythrina Folkersii (Plant) Rel Props:Reference:
17. Outgoing r'ship FOUND_IN to/from Erythrina Fusca (Plant) Rel Props:Reference:
18. Outgoing r'ship FOUND_IN to/from Erythrina Glauca (Plant) Rel Props:Reference:
19. Outgoing r'ship FOUND_IN to/from Erythrina Hypaphorus (Plant) Rel Props:Reference:
20. Outgoing r'ship FOUND_IN to/from Erythrina Latissima (Plant) Rel Props:Reference:
21. Outgoing r'ship FOUND_IN to/from Erythrina Lithosperma (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
22. Outgoing r'ship FOUND_IN to/from Erythrina Lysistemon (Plant) Rel Props:Reference:
23. Outgoing r'ship FOUND_IN to/from Erythrina Melanacantha (Plant) Rel Props:Reference:
24. Outgoing r'ship FOUND_IN to/from Erythrina Orientalis (Plant) Rel Props:Reference:
25. Outgoing r'ship FOUND_IN to/from Erythrina Pallida (Plant) Rel Props:Reference:
26. Outgoing r'ship FOUND_IN to/from Erythrina Poeppigiana (Plant) Rel Props:Reference:
27. Outgoing r'ship FOUND_IN to/from Erythrina Resupinata (Plant) Rel Props:Reference:
28. Outgoing r'ship FOUND_IN to/from Erythrina Sacleuxii (Plant) Rel Props:Reference:
29. Outgoing r'ship FOUND_IN to/from Erythrina Salviiflora (Plant) Rel Props:Reference:
30. Outgoing r'ship FOUND_IN to/from Erythrina Sandwicensis (Plant) Rel Props:Reference:
31. Outgoing r'ship FOUND_IN to/from Erythrina Senegalensis (Plant) Rel Props:Reference:
32. Outgoing r'ship FOUND_IN to/from Erythrina Sigmoidea (Plant) Rel Props:Reference:
33. Outgoing r'ship FOUND_IN to/from Erythrina Speciosa (Plant) Rel Props:Reference:
34. Outgoing r'ship FOUND_IN to/from Erythrina Stricta (Plant) Rel Props:Reference:
35. Outgoing r'ship FOUND_IN to/from Erythrina Suberosa (Plant) Rel Props:Reference:
36. Outgoing r'ship FOUND_IN to/from Erythrina Subumbrans (Plant) Rel Props:Reference:
37. Outgoing r'ship FOUND_IN to/from Erythrina Variegata (Plant) Rel Props:Reference:
38. Outgoing r'ship FOUND_IN to/from Erythrina Variegate (Plant) Rel Props:Reference:
39. Outgoing r'ship FOUND_IN to/from Erythrina Vogelii (Plant) Rel Props:Reference:
40. Outgoing r'ship FOUND_IN to/from Exacum Bicolor (Plant) Rel Props:Reference:
41. Outgoing r'ship FOUND_IN to/from Ferula Alliacea (Plant) Rel Props:Reference:
42. Outgoing r'ship FOUND_IN to/from Ferula Ammoniacum (Plant) Rel Props:Reference:
43. Outgoing r'ship FOUND_IN to/from Ferula Arrigonii (Plant) Rel Props:Reference:
44. Outgoing r'ship FOUND_IN to/from Ferula Asafoetida (Plant) Rel Props:Reference:
45. Outgoing r'ship FOUND_IN to/from Ferula Assafoetida (Plant) Rel Props:Reference:
46. Outgoing r'ship FOUND_IN to/from Ferula Borealis (Plant) Rel Props:Reference:
47. Outgoing r'ship FOUND_IN to/from Ferula Foetida (Plant) Rel Props:Reference:
48. Outgoing r'ship FOUND_IN to/from Ferula Fukanensis (Plant) Rel Props:Reference:
49. Outgoing r'ship FOUND_IN to/from Ferula Galbaniflua (Plant) Rel Props:Reference:
50. Outgoing r'ship FOUND_IN to/from Ferula Gummosa (Plant) Rel Props:Reference:
51. Outgoing r'ship FOUND_IN to/from Ferula Jaeschkeana (Plant) Rel Props:Reference:
52. Outgoing r'ship FOUND_IN to/from Ferula Kuhistanica (Plant) Rel Props:Reference:
53. Outgoing r'ship FOUND_IN to/from Ferula Moschata (Plant) Rel Props:Reference:
54. Outgoing r'ship FOUND_IN to/from Ferula Narther (Plant) Rel Props:Reference:
55. Outgoing r'ship FOUND_IN to/from Ferula Narthex (Plant) Rel Props:Reference:
56. Outgoing r'ship FOUND_IN to/from Ferula Oopoda (Plant) Rel Props:Reference:
57. Outgoing r'ship FOUND_IN to/from Ferula Ovina (Plant) Rel Props:Reference:
58. Outgoing r'ship FOUND_IN to/from Ferula Persica (Plant) Rel Props:Reference:
59. Outgoing r'ship FOUND_IN to/from Ferula Polyantha (Plant) Rel Props:Reference:
60. Outgoing r'ship FOUND_IN to/from Ferula Transiliensis (Plant) Rel Props:Reference:
61. Outgoing r'ship FOUND_IN to/from Gynura Bicolor (Plant) Rel Props:Reference:
62. Outgoing r'ship FOUND_IN to/from Impatiens Bicolor (Plant) Rel Props:Reference:
63. Outgoing r'ship FOUND_IN to/from Iris Pallida (Plant) Rel Props:Reference:
64. Outgoing r'ship FOUND_IN to/from Lespedeza Bicolor (Plant) Rel Props:Reference:
65. Outgoing r'ship FOUND_IN to/from Limonium Bicolor (Plant) Rel Props:Reference:
66. Outgoing r'ship FOUND_IN to/from Liriope Muscari (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
67. Outgoing r'ship FOUND_IN to/from Liriope Spicata (Plant) Rel Props:Reference:
68. Outgoing r'ship FOUND_IN to/from Macaranga Bicolor (Plant) Rel Props:Reference:
69. Outgoing r'ship FOUND_IN to/from Maharanga Bicolor (Plant) Rel Props:Reference:
70. Outgoing r'ship FOUND_IN to/from Muscari Botryoides (Plant) Rel Props:Reference:
71. Outgoing r'ship FOUND_IN to/from Muscari Paradoxum (Plant) Rel Props:Reference:
72. Outgoing r'ship FOUND_IN to/from Pholidota Pallida (Plant) Rel Props:Reference:
73. Outgoing r'ship FOUND_IN to/from Pityrogramma Calomelanos (Plant) Rel Props:Reference:
74. Outgoing r'ship FOUND_IN to/from Pityrogramma Ebenea (Plant) Rel Props:Reference:
75. Outgoing r'ship FOUND_IN to/from Pityrogramma Tartarea (Plant) Rel Props:Reference:
76. Outgoing r'ship FOUND_IN to/from Pogostemon Stellatus (Plant) Rel Props:Reference:
77. Outgoing r'ship FOUND_IN to/from Rudbeckia Bicolor (Plant) Rel Props:Reference:
78. Outgoing r'ship FOUND_IN to/from Scleria Lithosperma (Plant) Rel Props:Reference:
79. Outgoing r'ship FOUND_IN to/from Selaginella Apoda (Plant) Rel Props:Reference:
80. Outgoing r'ship FOUND_IN to/from Selaginella Braunii (Plant) Rel Props:Reference:
81. Outgoing r'ship FOUND_IN to/from Selaginella Bryopteris (Plant) Rel Props:Reference:
82. Outgoing r'ship FOUND_IN to/from Selaginella Chrysocaulos (Plant) Rel Props:Reference:
83. Outgoing r'ship FOUND_IN to/from Selaginella Davidii (Plant) Rel Props:Reference:
84. Outgoing r'ship FOUND_IN to/from Selaginella Doederleinii (Plant) Rel Props:Reference:
85. Outgoing r'ship FOUND_IN to/from Selaginella Involvens (Plant) Rel Props:Reference:
86. Outgoing r'ship FOUND_IN to/from Selaginella Labordei (Plant) Rel Props:Reference:
87. Outgoing r'ship FOUND_IN to/from Selaginella Moellendorffii (Plant) Rel Props:Reference:
88. Outgoing r'ship FOUND_IN to/from Selaginella Monosperma (Plant) Rel Props:Reference:
89. Outgoing r'ship FOUND_IN to/from Selaginella Omeiensis (Plant) Rel Props:Reference:
90. Outgoing r'ship FOUND_IN to/from Selaginella Pulvinata (Plant) Rel Props:Reference:
91. Outgoing r'ship FOUND_IN to/from Selaginella Radicata (Plant) Rel Props:Reference:
92. Outgoing r'ship FOUND_IN to/from Selaginella Repanda (Plant) Rel Props:Reference:
93. Outgoing r'ship FOUND_IN to/from Selaginella Rupestris (Plant) Rel Props:Reference:
94. Outgoing r'ship FOUND_IN to/from Selaginella Sanguinolenta (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all
95. Outgoing r'ship FOUND_IN to/from Selaginella Semicordata (Plant) Rel Props:Reference:
96. Outgoing r'ship FOUND_IN to/from Selaginella Sinensis (Plant) Rel Props:Reference:
97. Outgoing r'ship FOUND_IN to/from Selaginella Stauntoniana (Plant) Rel Props:Reference:
98. Outgoing r'ship FOUND_IN to/from Selaginella Tamariscina (Plant) Rel Props:Reference:
99. Outgoing r'ship FOUND_IN to/from Selaginella Uncinata (Plant) Rel Props:Reference:
100. Outgoing r'ship FOUND_IN to/from Sorghum Bicolor (Plant) Rel Props:Reference:
101. Outgoing r'ship FOUND_IN to/from Stenocereus Thurberi (Plant) Rel Props:Reference:
102. Outgoing r'ship FOUND_IN to/from Telosma Pallida (Plant) Rel Props:Reference:
103. Outgoing r'ship FOUND_IN to/from Terminalia Pallida (Plant) Rel Props:Reference:
104. Outgoing r'ship FOUND_IN to/from Torenia Bicolor (Plant) Rel Props:Reference:
105. Outgoing r'ship FOUND_IN to/from Tragia Bicolor (Plant) Rel Props:Reference:
106. Outgoing r'ship FOUND_IN to/from Vitis Pallida (Plant) Rel Props:Reference:

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Torularhodin

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Phytochemical Properties

Associated Connections 106

Plant Connections 106