| SpectraBase Spectrum ID |
AC2gDg2huk9 |
| Name |
(3aS,4S,7R,7aR)-7-hydroxy-4-[2-(5-hydroxy-2-methyl-phenyl)ethyl]-7a-methyl-2,3,3a,4,6,7-hexahydroindene-1,5-dione |
| CAS Registry Number |
79683-94-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H24O4 |
| InChI |
InChI=1S/C19H24O4/c1-11-3-5-13(20)9-12(11)4-6-14-15-7-8-17(22)19(15,2)18(23)10-16(14)21/h3,5,9,14-15,18,20,23H,4,6-8,10H2,1-2H3/t14-,15-,18+,19-/m0/s1 |
| InChIKey |
SCRZLRQVKYXYFZ-SAKMYQHLSA-N |
| Molecular Weight |
316.397 g/mol |
| SMILES |
Oc1ccc(c(CC[C@]2([C@]3([C@]([C@@](CC2=O)(O)[H])(C(CC3)=O)C)[H])[H])c1)C |
| SPLASH |
splash10-001i-0901000000-6bc2ab74b285a6a3f5e4 |
| Source of Spectrum |
F-37-1749-0 |
| Synonyms |
(3aS,4S,7R,7aR)-7-hydroxy-4-[2-(5-hydroxy-2-methyl-phenyl)ethyl]-7a-methyl-2,3,3a,4,6,7-hexahydroindene-1,5-quinone
(3aS,4S,7R,7aR)-7a-methyl-4-[2-(2-methyl-5-oxidanyl-phenyl)ethyl]-7-oxidanyl-2,3,3a,4,6,7-hexahydroindene-1,5-dione
12-Hydroxysecophenol
1H-indene-1,5(4H)-dione, hexahydro-7-hydroxy-4-(2-(5-hydroxy-2-methylphenyl)ethyl)-7a-methyl-, (3aS-(3aalpha,4alpha,7beta,7abeta))-
3,12-Dihydroxy-9(10)-secoandrosta-1,3,5(10)-triene-9,17-dione
3,12-Dsatd
Hexahydro-7-hydroxy-4-(2-(5-hydroxy-2-methylphenyl)ethyl)-7a-methyl-1H-indene-1,5(4H)-dione (3aS-(3aalpha,4alpha,7beta,7abeta))- |
| Wiley ID |
1316908 |
![(3aS,4S,7R,7aR)-7-hydroxy-4-[2-(5-hydroxy-2-methyl-phenyl)ethyl]-7a-methyl-2,3,3a,4,6,7-hexahydroindene-1,5-dione](/api/spectrum/AC2gDg2huk9/structure.png?h=300&w=458 "(3aS,4S,7R,7aR)-7-hydroxy-4-[2-(5-hydroxy-2-methyl-phenyl)ethyl]-7a-methyl-2,3,3a,4,6,7-hexahydroindene-1,5-dione")
