2'-PrenylsemilicoisoflavoneB
PubChem CID: 12096317
Connections displayed (default: 10).
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| Compound Synonyms | CHEMBL2442951, 2'-PrenylsemilicoisoflavoneB, BDBM50442395, 651750-10-6 |
|---|---|
| Topological Polar Surface Area | 96.2 |
| Hydrogen Bond Donor Count | 3.0 |
| Heavy Atom Count | 31.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 792.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Uniprot Id | P10481 |
| Iupac Name | 5,7-dihydroxy-3-[8-hydroxy-2,2-dimethyl-7-(3-methylbut-2-enyl)chromen-6-yl]chromen-4-one |
| Prediction Hob | 1.0 |
| Xlogp | 5.5 |
| Molecular Formula | C25H24O6 |
| Prediction Swissadme | 0.0 |
| Inchi Key | MXRSYAGBZPTIHM-UHFFFAOYSA-N |
| Fcsp3 | 0.24 |
| Logs | -2.819 |
| Rotatable Bond Count | 3.0 |
| Logd | 3.478 |
| Compound Name | 2'-PrenylsemilicoisoflavoneB |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 420.157 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 420.157 |
| Hydrogen Bond Acceptor Count | 6.0 |
| Molecular Weight | 420.5 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -5.610693683870968 |
| Inchi | InChI=1S/C25H24O6/c1-13(2)5-6-16-17(9-14-7-8-25(3,4)31-24(14)23(16)29)18-12-30-20-11-15(26)10-19(27)21(20)22(18)28/h5,7-12,26-27,29H,6H2,1-4H3 |
| Smiles | CC(=CCC1=C(C=C2C=CC(OC2=C1O)(C)C)C3=COC4=CC(=CC(=C4C3=O)O)O)C |
| Nring | 4.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Flemingia Bracteata (Plant) Rel Props:Reference: - 2. Outgoing r'ship
FOUND_INto/from Flemingia Chappar (Plant) Rel Props:Reference: - 3. Outgoing r'ship
FOUND_INto/from Flemingia Congesta (Plant) Rel Props:Reference: - 4. Outgoing r'ship
FOUND_INto/from Flemingia Grahamiana (Plant) Rel Props:Reference: - 5. Outgoing r'ship
FOUND_INto/from Flemingia Macrophylla (Plant) Rel Props:Reference: - 6. Outgoing r'ship
FOUND_INto/from Flemingia Nana (Plant) Rel Props:Reference: - 7. Outgoing r'ship
FOUND_INto/from Flemingia Paniculata (Plant) Rel Props:Reference: - 8. Outgoing r'ship
FOUND_INto/from Flemingia Philippinensis (Plant) Rel Props:Source_db:npass_chem_all - 9. Outgoing r'ship
FOUND_INto/from Flemingia Procumbens (Plant) Rel Props:Reference: - 10. Outgoing r'ship
FOUND_INto/from Flemingia Prostrata (Plant) Rel Props:Reference: - 11. Outgoing r'ship
FOUND_INto/from Flemingia Rhodocarpa (Plant) Rel Props:Reference: - 12. Outgoing r'ship
FOUND_INto/from Flemingia Stricta (Plant) Rel Props:Reference: - 13. Outgoing r'ship
FOUND_INto/from Flemingia Strobilifera (Plant) Rel Props:Reference: - 14. Outgoing r'ship
FOUND_INto/from Flemingia Tuberosa (Plant) Rel Props:Reference: - 15. Outgoing r'ship
FOUND_INto/from Mallotus Philippinensis (Plant) Rel Props:Reference: - 16. Outgoing r'ship
FOUND_INto/from Podocarpus Philippinensis (Plant) Rel Props:Reference: