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ent-11.alpha..-Hydroxy-2,3-seco-13-epi-manoyl oxide-2,3-dioic acid
SpectraBase Compound ID 8IQSCjzLqYG
InChI InChI=1S/C20H32O6/c1-7-18(4)10-12(21)15-19(5,11-14(22)23)13(17(2,3)16(24)25)8-9-20(15,6)26-18/h7,12-13,15,21H,1,8-11H2,2-6H3,(H,22,23)(H,24,25)/t12-,13?,15?,18-,19+,20-/m0/s1
InChIKey JRBIZYYWJGPNGZ-XVDGALCVSA-N
Mol Weight 368.5 g/mol
Molecular Formula C20H32O6
Exact Mass 368.219889 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Prfr0ls1HQ
Name ent-11.alpha..-Hydroxy-2,3-seco-13-epi-manoyl oxide-2,3-dioic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O6
InChI InChI=1S/C20H32O6/c1-7-18(4)10-12(21)15-19(5,11-14(22)23)13(17(2,3)16(24)25)8-9-20(15,6)26-18/h7,12-13,15,21H,1,8-11H2,2-6H3,(H,22,23)(H,24,25)/t12-,13?,15?,18-,19+,20-/m0/s1
InChIKey JRBIZYYWJGPNGZ-XVDGALCVSA-N
Molecular Weight 368.470 g/mol
SMILES O[C@]1(C[C@@](O[C@@]2(C1[C@@](C(C(C(=O)O)(C)C)CC2)(CC(=O)O)C)C)(C=C)C)[H]
SPLASH splash10-000i-0079000000-ea18ee5adc87fca0f201
Source of Spectrum F-55-1792-19
Synonyms 2-[(2R,4S,5R,8aS)-5-(carboxymethyl)-4-hydroxy-2,5,8a-trimethyl-2-vinyloctahydro-2H-chromen-6-yl]-2-methylpropanoic acid
Wiley ID 836685