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6S-2,6-DIMETHYL-6-O-BETA-D-QUINOVOPYRANOSYL-7-OCTAENOIC-ACID
SpectraBase Compound ID 4CRKtZ0agti
InChI InChI=1S/C16H28O7/c1-5-16(4,8-6-7-9(2)14(20)21)23-15-13(19)12(18)11(17)10(3)22-15/h5,9-13,15,17-19H,1,6-8H2,2-4H3,(H,20,21)/t9?,10-,11-,12+,13-,15?,16+/m0/s1
InChIKey RMLMMXWVQHEIFK-QEWMGTMXSA-N
Mol Weight 332.39 g/mol
Molecular Formula C16H28O7
Exact Mass 332.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AmAmbHEu2nd
Name 6S-2,6-DIMETHYL-6-O-BETA-D-QUINOVOPYRANOSYL-7-OCTAENOIC-ACID
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28O7
InChI InChI=1S/C16H28O7/c1-5-16(4,8-6-7-9(2)14(20)21)23-15-13(19)12(18)11(17)10(3)22-15/h5,9-13,15,17-19H,1,6-8H2,2-4H3,(H,20,21)/t9?,10-,11-,12+,13-,15?,16+/m0/s1
InChIKey RMLMMXWVQHEIFK-QEWMGTMXSA-N
Literature Reference Author K.YOSHIKAWA,Y.SATOU,Y.TOKUNAGA,M.TANAKA,S.ARIHARA,S.K.NIGAM
Literature Reference Citation J.NAT.PROD.,61,440(1998)
Literature Reference DOI 10.1021/np970538r
Molecular Weight 332.394 g/mol
Solvent C5D5N
Source File Reference UWCP972