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Cycloart-25-ene-3.beta.,24-diol
SpectraBase Compound ID BYEhIliRwiN
InChI InChI=1S/C30H50O2/c1-19(2)22(31)9-8-20(3)21-12-14-28(7)24-11-10-23-26(4,5)25(32)13-15-29(23)18-30(24,29)17-16-27(21,28)6/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21-,22?,23+,24+,25+,27-,28+,29-,30+/m1/s1
InChIKey MHGLNDDJLDJDBG-GSYFYXRESA-N
Mol Weight 442.7 g/mol
Molecular Formula C30H50O2
Exact Mass 442.381081 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8sTzQrNrKQ2
Name Cycloart-25-ene-3.beta.,24-diol
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O2
InChI InChI=1S/C30H50O2/c1-19(2)22(31)9-8-20(3)21-12-14-28(7)24-11-10-23-26(4,5)25(32)13-15-29(23)18-30(24,29)17-16-27(21,28)6/h20-25,31-32H,1,8-18H2,2-7H3/t20-,21-,22?,23+,24+,25+,27-,28+,29-,30+/m1/s1
InChIKey MHGLNDDJLDJDBG-GSYFYXRESA-N
Molecular Weight 442.728 g/mol
SMILES O[C@@]1(C([C@]2([C@@]3([C@@]4(CC[C@@]5([C@@]([C@@](CCC(C(=C)C)O)(C)[H])(CC[C@]5([C@@]4(CC2)[H])C)[H])C)C3)CC1)[H])(C)C)[H]
SPLASH splash10-004i-0900000000-3cf18ba471216af7f0ba
Source of Spectrum QA-44-323-13
Synonyms (1R,3aS,3bS,5aR,7S,9aR,10aS,12aR)-1-[(1R)-4-hydroxy-1,5-dimethyl-5-hexenyl]-3a,6,6,12a-tetramethyltetradecahydro-1H-cyclopenta[a]cyclopropa[e]phenanthren-7-ol Cycloart-23-ene-3.beta.,24-diol
Wiley ID 862435