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TINOSPOSINENSIDE_B
SpectraBase Compound ID FhW8hDcTuSp
InChI InChI=1S/C28H38O13/c1-12(30)37-18-8-17(40-27-24(34)23(33)22(32)20(10-29)41-27)15-4-5-16-26(35)39-19(14-6-7-36-11-14)9-28(16,3)21(15)25(18)38-13(2)31/h6-7,11,15-25,27,29,32-34H,4-5,8-10H2,1-3H3/t15-,16+,17-,18+,19+,20-,21+,22-,23+,24-,25+,27-,28-/m1/s1
InChIKey PESHKZMKILHZFJ-FFQWAIAZSA-N
Mol Weight 582.6 g/mol
Molecular Formula C28H38O13
Exact Mass 582.231241 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BJHlunRqqfV
Name TINOSPOSINENSIDE_B
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H38O13
InChI InChI=1S/C28H38O13/c1-12(30)37-18-8-17(40-27-24(34)23(33)22(32)20(10-29)41-27)15-4-5-16-26(35)39-19(14-6-7-36-11-14)9-28(16,3)21(15)25(18)38-13(2)31/h6-7,11,15-25,27,29,32-34H,4-5,8-10H2,1-3H3/t15-,16+,17-,18+,19+,20-,21+,22-,23+,24-,25+,27-,28-/m1/s1
InChIKey PESHKZMKILHZFJ-FFQWAIAZSA-N
Literature Reference Author W.LI,K.WEI,H.FU,K.KOIKE
Literature Reference Citation J.NAT.PROD.,70,1971(2007)
Literature Reference DOI 10.1021/np070367i
Molecular Weight 582.602 g/mol
Sample ID 31220
Solvent CD3OD