5,7-Dihydroxy-6-geranylchromone
PubChem CID: 129834645
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| Compound Synonyms | CHEMBL4282134, 5,7-dihydroxy-6-geranylchromone, BDBM50468225 |
|---|---|
| Topological Polar Surface Area | 66.8 |
| Hydrogen Bond Donor Count | 2.0 |
| Heavy Atom Count | 23.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 513.0 |
| Database Name | cmaup_ingredients;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 6-[(2E)-3,7-dimethylocta-2,6-dienyl]-5,7-dihydroxychromen-4-one |
| Prediction Hob | 1.0 |
| Target Id | NPT570 |
| Xlogp | 5.2 |
| Molecular Formula | C19H22O4 |
| Prediction Swissadme | 1.0 |
| Inchi Key | DAXMJFQUZKBFJD-NTUHNPAUSA-N |
| Fcsp3 | 0.3157894736842105 |
| Logs | -3.2 |
| Rotatable Bond Count | 5.0 |
| Logd | 3.28 |
| Compound Name | 5,7-Dihydroxy-6-geranylchromone |
| Prediction Hob Swissadme | 1.0 |
| Exact Mass | 314.152 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 314.152 |
| Hydrogen Bond Acceptor Count | 4.0 |
| Molecular Weight | 314.4 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 1.0 |
| Esol | -4.200101330434783 |
| Inchi | InChI=1S/C19H22O4/c1-12(2)5-4-6-13(3)7-8-14-16(21)11-17-18(19(14)22)15(20)9-10-23-17/h5,7,9-11,21-22H,4,6,8H2,1-3H3/b13-7+ |
| Smiles | CC(=CCC/C(=C/CC1=C(C2=C(C=C1O)OC=CC2=O)O)/C)C |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 1.0 |
- 1. Outgoing r'ship
FOUND_INto/from Paulownia Tomentosa (Plant) Rel Props:Source_db:cmaup_ingredients