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(5E,7E)-9,10-Secocholesta-5,7-diene-3,25-diol
SpectraBase Compound ID LLFjxrC1apX
InChI InChI=1S/C27H46O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,19-20,23-25,28-29H,6-10,13-18H2,1-5H3/b21-11+,22-12+
InChIKey OAEHUEZTKKWVAX-XHQRYOPUSA-N
Mol Weight 402.7 g/mol
Molecular Formula C27H46O2
Exact Mass 402.349781 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XEEtzWpJh
Name (5E,7E)-9,10-Secocholesta-5,7-diene-3,25-diol
Alternate Name(s) (3E)-3-[(2E)-2-[1-(5-hydroxy-1,5-dimethyl-hexyl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methyl-cyclohexanol (3E)-3-[(2E)-2-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methyl-1-cyclohexanol (3E)-3-[(2E)-2-[1-(6-hydroxy-6-methylheptan-2-yl)-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methylcyclohexan-1-ol (3E)-3-[(2E)-2-[7a-methyl-1-(6-methyl-6-oxidanyl-heptan-2-yl)-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]-4-methyl-cyclohexan-1-ol 25-Hydroxydihydrotachysterol(3) 9,10-Secocholesta-5,7-diene-3beta,25-diol Tachysterol3, dihydro-25-hydroxy-
CAS Registry Number 25631-39-4
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Formula C27H46O2
InChI InChI=1S/C27H46O2/c1-19-10-13-23(28)18-22(19)12-11-21-9-7-17-27(5)24(14-15-25(21)27)20(2)8-6-16-26(3,4)29/h11-12,19-20,23-25,28-29H,6-10,13-18H2,1-5H3/b21-11+,22-12+
InChIKey OAEHUEZTKKWVAX-XHQRYOPUSA-N
Molecular Weight 402.663 g/mol
SMILES OC(CCCC(C1CCC2\C(=C\C=C/3CC(CCC3C)O)CCCC12C)C)(C)C
SPLASH splash10-05fs-5920000000-8254ebfc1a6a9cbfe330
Source of Spectrum D-9-1654-2
Wiley ID 1370661