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16alpha-Hydro-19-al-ent-kauran-17-oic acid
SpectraBase Compound ID 4MRbxVwS4lk
InChI InChI=1S/C20H30O3/c1-18(12-21)7-3-8-19(2)15(18)6-9-20-10-13(4-5-16(19)20)14(11-20)17(22)23/h12-16H,3-11H2,1-2H3,(H,22,23)/t13-,14-,15+,16-,18-,19+,20-/m0/s1
InChIKey KVKFKHMIIMGSRS-VPPJIXMVSA-N
Mol Weight 318.46 g/mol
Molecular Formula C20H30O3
Exact Mass 318.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A106V9laa
Name 16alpha-Hydro-19-al-ent-kauran-17-oic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O3
InChI InChI=1S/C20H30O3/c1-18(12-21)7-3-8-19(2)15(18)6-9-20-10-13(4-5-16(19)20)14(11-20)17(22)23/h12-16H,3-11H2,1-2H3,(H,22,23)/t13-,14-,15+,16-,18-,19+,20-/m0/s1
InChIKey KVKFKHMIIMGSRS-VPPJIXMVSA-N
Literature Reference DOI 10.1002/jccs.200400131
Molecular Weight 318.457 g/mol
SMILES OC([C@@]1([C@]2(CC[C@]3([C@@]4(CCC[C@]([C@@]4([H])CC[C@]3(C2)C1)(C=O)C)C)[H])[H])[H])=O
SPLASH splash10-05g0-0940000000-08e1426d0153c4ac3366
Source of Spectrum QA-51-874-15
Synonyms (4R,4aS,6aS,8S,9S,11aR,11bS)-4-formyl-4,11b-dimethyltetradecahydro-6a,9-methanocyclohepta[a]naphthalene-8-carboxylic acid
Wiley ID 1795968