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5.alpha.-Cholest-7,24-diene-3.beta.,6.alpha.-diol - Diacetate
SpectraBase Compound ID 7mQSfWc8t00
InChI InChI=1S/C31H48O4/c1-19(2)9-8-10-20(3)25-11-12-26-24-18-29(35-22(5)33)28-17-23(34-21(4)32)13-15-31(28,7)27(24)14-16-30(25,26)6/h9,18,20,23,25-29H,8,10-17H2,1-7H3/t20-,23+,25-,26+,27+,28-,29+,30-,31-/m1/s1
InChIKey YHGJLHINROOLBC-NODBSLBASA-N
Mol Weight 484.7 g/mol
Molecular Formula C31H48O4
Exact Mass 484.35526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Lb2iOWLfhR
Name 5.alpha.-Cholest-7,24-diene-3.beta.,6.alpha.-diol - Diacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H48O4
InChI InChI=1S/C31H48O4/c1-19(2)9-8-10-20(3)25-11-12-26-24-18-29(35-22(5)33)28-17-23(34-21(4)32)13-15-31(28,7)27(24)14-16-30(25,26)6/h9,18,20,23,25-29H,8,10-17H2,1-7H3/t20-,23+,25-,26+,27+,28-,29+,30-,31-/m1/s1
InChIKey YHGJLHINROOLBC-NODBSLBASA-N
Molecular Weight 484.721 g/mol
SMILES C1=2[C@@]([C@]3(CC[C@](OC(=O)C)(C[C@@]3([C@](C2)(OC(=O)C)[H])[H])[H])C)(CC[C@]2([C@]1(CC[C@@]2([C@@](CCC=C(C)C)(C)[H])[H])[H])C)[H]
SPLASH splash10-0xr1-1069100000-3dd55bf9096d1047553e
Source of Spectrum X2-49-783-2
Synonyms (3beta,5alpha,6alpha)-3-(acetyloxy)cholesta-7,24-dien-6-yl acetate
Wiley ID 1602000