| 2D Structure | |
| CID | 9928523 |
| Target | / |
| IUPAC Name | (2S)-7-hydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one |
| InChI | InChI=1S/C21H22O5/c1-12(2)4-9-15-16(23)10-19(25-3)20-17(24)11-18(26-21(15)20)13-5-7-14(22)8-6-13/h4-8,10,18,22-23H,9,11H2,1-3H3/t18-/m0/s1 |
| InChI Key | YKGCBLWILMDSAV-SFHVURJKSA-N |
| Canonical SMILES | CC(=CCC1=C2C(=C(C=C1O)OC)C(=O)CC(O2)C3=CC=C(C=C3)O)C |
| Isomeric SMILES | CC(=CCC1=C2C(=C(C=C1O)OC)C(=O)C[C@H](O2)C3=CC=C(C=C3)O)C |
| Molecular Formula | C21H22O5 |
| Molecular Weight | 354.4 |
| synonyms | ['70872-29-6', '(2S)-Isoxanthohumol', '(-)-Isoxanthohumol', '(S)-7-Hydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-en-1-yl)chroman-4-one', '(2S)-7-hydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one', 'YKGCBLWILMDSAV-SFHVURJKSA-N', 'Isoxanthohumol, (-)-', 'Isoxanthohumol (sophora)', 'X4YHZ98N7Q', 'CHEMBL4160626', 'SCHEMBL14092988', 'DTXSID101045280', 'HY-N2584', 'MSK179976', 's9070', 'AKOS032949010', 'CCG-268085', 'AC-35040', 'MS-25528', 'CS-0022926', 'I1065', "(2s)-7,4'-dihydroxy-5-methoxy-8-(gamma,gamma-dimethylallyl)-flavanone", '(2S)-2-(4-Hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)-7-oxidanyl-2,3-dihydrochromen-4-one', '4H-1-Benzopyran-4-one, 2,3-dihydro-7-hydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methyl-2-buten-1-yl)-, (2S)-', 'Isoxanthohumol(S)-7-Hydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-en-1-yl)chroman-4-one; (2S)-7-hydroxy-2-(4-hydroxyphenyl)-5-methoxy-8-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one'] |
From Pubchem