Eryvarin D
PubChem CID: 15546808
Connections displayed (default: 10).
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| Compound Synonyms | eryvarin D, CHEMBL1097045, 9-methoxy-10-(3-methylbut-2-enyl)-6H-(1)benzofuro(3,2-c)chromen-3-ol, 9-methoxy-10-(3-methylbut-2-enyl)-6H-[1]benzofuro[3,2-c]chromen-3-ol, BDBM50317434, 406676-79-7 |
|---|---|
| Topological Polar Surface Area | 51.8 |
| Hydrogen Bond Donor Count | 1.0 |
| Heavy Atom Count | 25.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 500.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P10481, P0C6E9 |
| Iupac Name | 9-methoxy-10-(3-methylbut-2-enyl)-6H-[1]benzofuro[3,2-c]chromen-3-ol |
| Prediction Hob | 1.0 |
| Xlogp | 5.1 |
| Molecular Formula | C21H20O4 |
| Prediction Swissadme | 0.0 |
| Inchi Key | BYZVMAQRPFEPSV-UHFFFAOYSA-N |
| Fcsp3 | 0.238095238095238 |
| Logs | -5.159 |
| Rotatable Bond Count | 3.0 |
| Logd | 4.287 |
| Compound Name | Eryvarin D |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 336.136 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 336.136 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 336.4 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.3656994 |
| Inchi | InChI=1S/C21H20O4/c1-12(2)4-6-15-18(23-3)9-8-14-17-11-24-19-10-13(22)5-7-16(19)21(17)25-20(14)15/h4-5,7-10,22H,6,11H2,1-3H3 |
| Smiles | CC(=CCC1=C(C=CC2=C1OC3=C2COC4=C3C=CC(=C4)O)OC)C |
| Nring | 4.0 |
| Defined Bond Stereocenter Count | 0.0 |
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FOUND_INto/from Erythrina Abyssinica (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all - 8. Outgoing r'ship
FOUND_INto/from Erythrina Americana (Plant) Rel Props:Reference: - 9. Outgoing r'ship
FOUND_INto/from Erythrina Arborescens (Plant) Rel Props:Reference: - 10. Outgoing r'ship
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FOUND_INto/from Erythrina Chiriquensis (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Erythrina Folkersii (Plant) Rel Props:Reference: - 14. Outgoing r'ship
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FOUND_INto/from Erythrina Lithosperma (Plant) Rel Props:Reference: - 19. Outgoing r'ship
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