Psorospermin
PubChem CID: 126451
Connections displayed (default: 10).
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| Compound Synonyms | Psorospermin, 74045-97-9, (2R)-10-hydroxy-5-methoxy-2-[(2R)-2-methyloxiran-2-yl]-1,2-dihydrofuro[2,3-c]xanthen-6-one, CHEBI:8617, CHEMBL369474, C10090, psorospermine, AC1L2QCN, SCHEMBL12312454, DTXSID60995463, 6H-Furo(2,3-c)xanthen-6-one, 1,2-dihydro-10-hydroxy-5-methoxy-2-(2-methyloxiranyl)-, Q27108114, 10-Hydroxy-5-methoxy-2-(2-methyloxiran-2-yl)-1,2-dihydro-6H-furo[2,3-c]xanthen-6-one, (2r)-10-hydroxy-5-methoxy-2-[(2r)-2-methyloxiran-2-yl]-1,2-dihydro-6h-furo[2,3-c]xanthen-6-one |
|---|---|
| Topological Polar Surface Area | 77.5 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 25.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 566.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 2.0 |
| Uniprot Id | n.a. |
| Iupac Name | (2R)-10-hydroxy-5-methoxy-2-[(2R)-2-methyloxiran-2-yl]-1,2-dihydrofuro[2,3-c]xanthen-6-one |
| Prediction Hob | 1.0 |
| Xlogp | 2.5 |
| Molecular Formula | C19H16O6 |
| Prediction Swissadme | 1.0 |
| Inchi Key | BBNDPXOGORGETN-AUUYWEPGSA-N |
| Fcsp3 | 0.3157894736842105 |
| Logs | -4.913 |
| Rotatable Bond Count | 2.0 |
| Logd | 2.582 |
| Compound Name | Psorospermin |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 340.095 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 340.095 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 340.3 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 2.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -4.166552200000001 |
| Inchi | InChI=1S/C19H16O6/c1-19(8-23-19)14-6-10-12(24-14)7-13(22-2)15-16(21)9-4-3-5-11(20)17(9)25-18(10)15/h3-5,7,14,20H,6,8H2,1-2H3/t14-,19-/m1/s1 |
| Smiles | C[C@@]1(CO1)[C@H]2CC3=C4C(=C(C=C3O2)OC)C(=O)C5=C(O4)C(=CC=C5)O |
| Nring | 5.0 |
| Defined Bond Stereocenter Count | 0.0 |
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FOUND_INto/from Ajuga Australis (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Ajuga Bracteosa (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Ajuga Chamaepitys (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Ajuga Ciliata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 6. Outgoing r'ship
FOUND_INto/from Ajuga Decumbens (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Ajuga Forrestii (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Ajuga Genevensis (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Ajuga Integrifolia (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Ajuga Lupulina (Plant) Rel Props:Reference: - 11. Outgoing r'ship
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FOUND_INto/from Ajuga Taiwanensis (Plant) Rel Props:Reference: - 19. Outgoing r'ship
FOUND_INto/from Angylocalyx Braunii (Plant) Rel Props:Reference: - 20. Outgoing r'ship
FOUND_INto/from Angylocalyx Oligophyllus (Plant) Rel Props:Reference: - 21. Outgoing r'ship
FOUND_INto/from Angylocalyx Pynaertii (Plant) Rel Props:Reference: - 22. Outgoing r'ship
FOUND_INto/from Bergenia Ciliata (Plant) Rel Props:Reference: - 23. Outgoing r'ship
FOUND_INto/from Clerodendrum Bracteatum (Plant) Rel Props:Reference: - 24. Outgoing r'ship
FOUND_INto/from Clerodendrum Bungei (Plant) Rel Props:Reference: - 25. Outgoing r'ship
FOUND_INto/from Clerodendrum Calamitosum (Plant) Rel Props:Reference: - 26. Outgoing r'ship
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FOUND_INto/from Clerodendrum Colebrookianum (Plant) Rel Props:Reference: - 28. Outgoing r'ship
FOUND_INto/from Clerodendrum Cyrtophyllum (Plant) Rel Props:Reference: - 29. Outgoing r'ship
FOUND_INto/from Clerodendrum Glandulosum (Plant) Rel Props:Reference: - 30. Outgoing r'ship
FOUND_INto/from Clerodendrum Indicum (Plant) Rel Props:Reference: - 31. Outgoing r'ship
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FOUND_INto/from Clerodendrum Kaempferi (Plant) Rel Props:Reference: - 34. Outgoing r'ship
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FOUND_INto/from Clerodendrum Viscosum (Plant) Rel Props:Reference: - 46. Outgoing r'ship
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FOUND_INto/from Delphinium Fangshanense (Plant) Rel Props:Reference: - 62. Outgoing r'ship
FOUND_INto/from Delphinium Giraldii (Plant) Rel Props:Reference: - 63. Outgoing r'ship
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FOUND_INto/from Delphinium Nuttallianum (Plant) Rel Props:Reference: - 67. Outgoing r'ship
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FOUND_INto/from Delphinium Yunnanense (Plant) Rel Props:Reference: - 81. Outgoing r'ship
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FOUND_INto/from Erythrina Berteroana (Plant) Rel Props:Reference: - 88. Outgoing r'ship
FOUND_INto/from Erythrina Burttii (Plant) Rel Props:Reference: - 89. Outgoing r'ship
FOUND_INto/from Erythrina Chiriquensis (Plant) Rel Props:Reference: - 90. Outgoing r'ship
FOUND_INto/from Erythrina Folkersii (Plant) Rel Props:Reference: - 91. Outgoing r'ship
FOUND_INto/from Erythrina Fusca (Plant) Rel Props:Reference: - 92. Outgoing r'ship
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FOUND_INto/from Erythrina Hypaphorus (Plant) Rel Props:Reference: - 94. Outgoing r'ship
FOUND_INto/from Erythrina Latissima (Plant) Rel Props:Reference: - 95. Outgoing r'ship
FOUND_INto/from Erythrina Lithosperma (Plant) Rel Props:Reference: - 96. Outgoing r'ship
FOUND_INto/from Erythrina Lysistemon (Plant) Rel Props:Reference: - 97. Outgoing r'ship
FOUND_INto/from Erythrina Melanacantha (Plant) Rel Props:Reference: - 98. Outgoing r'ship
FOUND_INto/from Erythrina Orientalis (Plant) Rel Props:Reference: - 99. Outgoing r'ship
FOUND_INto/from Erythrina Pallida (Plant) Rel Props:Reference: - 100. Outgoing r'ship
FOUND_INto/from Erythrina Poeppigiana (Plant) Rel Props:Reference: - 101. Outgoing r'ship
FOUND_INto/from Erythrina Resupinata (Plant) Rel Props:Reference: - 102. Outgoing r'ship
FOUND_INto/from Erythrina Sacleuxii (Plant) Rel Props:Reference: - 103. Outgoing r'ship
FOUND_INto/from Erythrina Salviiflora (Plant) Rel Props:Reference: - 104. Outgoing r'ship
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FOUND_INto/from Erythrina Subumbrans (Plant) Rel Props:Reference: - 111. Outgoing r'ship
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FOUND_INto/from Eupatorium Gracile (Plant) Rel Props:Reference: - 115. Outgoing r'ship
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FOUND_INto/from Justicia Ciliata (Plant) Rel Props:Reference: - 120. Outgoing r'ship
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FOUND_INto/from Populus Ciliata (Plant) Rel Props:Reference: - 127. Outgoing r'ship
FOUND_INto/from Psorospermum Adamauense (Plant) Rel Props:Reference: - 128. Outgoing r'ship
FOUND_INto/from Psorospermum Febrifugum (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 129. Outgoing r'ship
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