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3-Furanmethanol, .alpha.-[1-(1,3-dithian-2-ylidenemethyl)-1,2,3,4,4a,4b,5,6,7,8,10,10a -dodecahydro-7-hydroxy-2,4b-dimethyl-2-phenanthrenyl]-
SpectraBase Compound ID InlozMYd0Pb
InChI InChI=1S/C26H36O3S2/c1-25-9-6-19(27)14-18(25)4-5-20-21(25)7-10-26(2,24(28)17-8-11-29-16-17)22(20)15-23-30-12-3-13-31-23/h4,8,11,15-16,19-22,24,27-28H,3,5-7,9-10,12-14H2,1-2H3
InChIKey OGNXJPHRLFSGRQ-UHFFFAOYSA-N
Mol Weight 460.7 g/mol
Molecular Formula C26H36O3S2
Exact Mass 460.210587 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6hTBCZIWP2g
Name 3-Furanmethanol, .alpha.-[1-(1,3-dithian-2-ylidenemethyl)-1,2,3,4,4a,4b,5,6,7,8,10,10a -dodecahydro-7-hydroxy-2,4b-dimethyl-2-phenanthrenyl]-
CAS Registry Number 80115-35-1
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36O3S2
InChI InChI=1S/C26H36O3S2/c1-25-9-6-19(27)14-18(25)4-5-20-21(25)7-10-26(2,24(28)17-8-11-29-16-17)22(20)15-23-30-12-3-13-31-23/h4,8,11,15-16,19-22,24,27-28H,3,5-7,9-10,12-14H2,1-2H3
InChIKey OGNXJPHRLFSGRQ-UHFFFAOYSA-N
Molecular Weight 460.691 g/mol
SMILES OC(C1(CCC2C(CC=C3CC(CCC23C)O)C1C=C1SCCCS1)C)c1cocc1
SPLASH splash10-0udi-0219200000-d0122a50b3b985e1926a
Source of Spectrum H-64-1403-0
Synonyms 1,3-Dithiane, 3-furanmethanol deriv. 17.sigma.-(3'-furyl)-16,16-trimethylendithio-16,17-seco-5,15-androstadiene-3.beta.,17-diol 8-(1,3-dithian-2-ylidenemethyl)-7-[3-furyl(hydroxy)methyl]-4a,7-dimethyl-1,2,3,4,4a,4b,5,6,7,8,8a,9-dodecahydro-2-phenanthrenol
Wiley ID 1390510