Vitamin D5
Molecular Formula:
C29H48O
InChI: InChI=1/C29H48O/c1-7-23(20(2)3)12-10-22(5)27-16-17-28-24(9-8-18-29(27,28)6)13-14-25-19-26(30)15-11-21(25)4/h13-14,20,22-23,26-28,30H,4,7-12,15-19H2,1-3,5-6H3/b24-13+,25-14-/t22-,23+,26+,27-,28+,29-/m1/s1
InChIKey: InChIKey=RMDJVOZETBHEAR-GHTRHTQZBN
SMILES: CCC(CCC(C)C1CCC2C1(CCCC2=CC=C3CC(CCC3=C)O)C)C(C)C
Names:
LMST03040002
Vitamin D5
(1S,3Z)-3-[(2E)-2-[(1R,3aR,7aR)-1-[(2R,5S)-5-ethyl-6-methyl-heptan-2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylidene-cyclohexan-1-ol
(5Z,7E)-(3S)-9,10-seco-5,7,10(19)-poriferastatrien-3-ol
(5Z,7E)-(3S,24S)-24-ethyl-9,10-seco-5,7,10(19)-cholestatrien-3-ol
Registries:
PubChem CID 9547700
PubChem ID 14715480
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