Catalog Number:
AG00GU6L
Chemical Name:
(1R,3S)-5-[2-[(1R,3aR,7aS)-1-[(2R,5S)-5-hydroxy-6-methyl-heptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexane-1,3-diol
CAS Number:
93129-94-3
Molecular Formula:
C27H46O4
Molecular Weight:
434.6517
MDL Number:
MFCD13184757
IUPAC Name:
(1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(2R,5R)-5-hydroxy-6-methylheptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidenecyclohexane-1,3-diol;hydrate
InChI:
InChI=1S/C27H44O3.H2O/c1-17(2)25(29)13-8-18(3)23-11-12-24-20(7-6-14-27(23,24)5)9-10-21-15-22(28)16-26(30)19(21)4;/h9-10,17-18,22-26,28-30H,4,6-8,11-16H2,1-3,5H3;1H2/b20-9+,21-10-;/t18-,22-,23-,24+,25-,26+,27-;/m1./s1
InChI Key:
UCLYOJXQGOXQKJ-XXBHHXRKSA-N
SMILES:
OC1CC(O)C(=C)C(=CC=C2CCCC3(C2CCC3C(CCC(C(C)C)O)C)C)C1.O
UNII:
B3Q63NVN9R
