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Olean-12-ene-3,16,22,28-tetrol, (3.beta.,16.beta.,22.alpha.)-
SpectraBase Compound ID Kcx3VNRwD3i
InChI InChI=1S/C30H50O4/c1-25(2)14-19-18-8-9-21-27(5)12-11-22(32)26(3,4)20(27)10-13-28(21,6)29(18,7)16-24(34)30(19,17-31)23(33)15-25/h8,19-24,31-34H,9-17H2,1-7H3
InChIKey CTNHZEZBBGIUJB-UHFFFAOYSA-N
Mol Weight 474.7 g/mol
Molecular Formula C30H50O4
Exact Mass 474.37091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KWa60014SPZ
Name Olean-12-ene-3,16,22,28-tetrol, (3.beta.,16.beta.,22.alpha.)-
CAS Registry Number 474-15-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O4
InChI InChI=1S/C30H50O4/c1-25(2)14-19-18-8-9-21-27(5)12-11-22(32)26(3,4)20(27)10-13-28(21,6)29(18,7)16-24(34)30(19,17-31)23(33)15-25/h8,19-24,31-34H,9-17H2,1-7H3
InChIKey CTNHZEZBBGIUJB-UHFFFAOYSA-N
Molecular Weight 474.726 g/mol
SMILES OCC12C(CC(CC2C=2C(CC1O)(C)C1(C)C(CC2)C2(C)C(CC1)C(C)(C)C(CC2)O)(C)C)O
SPLASH splash10-00kb-0980000000-b7d59990160b4bd9b0dd
Source of Spectrum EP-2266-0-0
Synonyms Olean-12-ene-3,16,22,28-tetrol 4,4,6a,6b,11,11,14b-heptamethyl-8a-methylol-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8,9-triol 8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-3,8,9-triol Chichipegenin Olean-12-ene-3.beta.,16.beta.,22.alpha.,28-tetrol
Wiley ID 1394004