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ent-6.alpha..-Hydroxy-2,3-seco-13-epi-manoyl oxide-2,3-dioic acid
SpectraBase Compound ID 8a3230e3wx0
InChI InChI=1S/C20H32O6/c1-7-18(4)9-8-13-19(5,11-14(22)23)15(17(2,3)16(24)25)12(21)10-20(13,6)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 PWIPOLHABKZPMK-PCZOEYQKSA-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 8SMZEajqcSs
Name ent-6.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)9-8-13-19(5,11-14(22)23)15(17(2,3)16(24)25)12(21)10-20(13,6)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 PWIPOLHABKZPMK-PCZOEYQKSA-N
Molecular Weight 368.470 g/mol
SMILES OC(C(C1[C@@](CC(=O)O)(C2[C@](C[C@@]1(O)[H])(O[C@](CC2)(C=C)C)C)C)(C)C)=O
SPLASH splash10-000i-0159000000-df899bbdb0353263013e
Source of Spectrum F-55-1791-17
Synonyms 2-[(2R,5R,7S,8aS)-5-(carboxymethyl)-7-hydroxy-2,5,8a-trimethyl-2-vinyloctahydro-2H-chromen-6-yl]-2-methylpropanoic acid
Wiley ID 836687