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2'-(3.alpha.-Benzyloxy-5.beta.-norcholan)propan-2'-ol
SpectraBase Compound ID 97ZwTc15Bvr
InChI InChI=1S/C33H52O2/c1-6-22(3)27-15-16-28-25-14-13-24-19-31(35-21-23-11-9-8-10-12-23)26(30(34)7-2)20-33(24,5)29(25)17-18-32(27,28)4/h8-12,22,24-31,34H,6-7,13-21H2,1-5H3/t22-,24-,25+,26?,27?,28+,29+,30?,31+,32-,33+/m1/s1
InChIKey TUNVGQMSRKJGPR-OILYRMTJSA-N
Mol Weight 480.8 g/mol
Molecular Formula C33H52O2
Exact Mass 480.396731 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4vRbhlr4nsk
Name 2'-(3.alpha.-Benzyloxy-5.beta.-norcholan)propan-2'-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H52O2
InChI InChI=1S/C33H52O2/c1-6-22(3)27-15-16-28-25-14-13-24-19-31(35-21-23-11-9-8-10-12-23)26(30(34)7-2)20-33(24,5)29(25)17-18-32(27,28)4/h8-12,22,24-31,34H,6-7,13-21H2,1-5H3/t22-,24-,25+,26?,27?,28+,29+,30?,31+,32-,33+/m1/s1
InChIKey TUNVGQMSRKJGPR-OILYRMTJSA-N
Molecular Weight 480.777 g/mol
SMILES OC(C1C[C@@]2([C@@]3([C@@]([C@@]4(CCC([C@]4(CC3)C)[C@@](CC)(C)[H])[H])([H])CC[C@@]2(C[C@@]1(OCc1ccccc1)[H])[H])[H])C)CC
SPLASH splash10-0a4l-6259200000-ce2b0fe92e5c5b4049d7
Source of Spectrum F-48-145-9
Synonyms 1-[(1S,2S,5S,7R,10R,11S,15R)-5-(benzyloxy)-14-[(2R)-butan-2-yl]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-4-yl]propan-1-ol
Wiley ID 1395342