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ZYGOPHYLOSIDE-D;3-O-[BETA-D-2-O-SULPHONYL-QUINOVOPYRANOSYL]-QUINOVIC-ACID
SpectraBase Compound ID 5pmawrCgZrc
InChI InChI=1S/C36H56O12S/c1-18-10-15-35(30(39)40)16-17-36(31(41)42)21(25(35)19(18)2)8-9-23-33(6)13-12-24(32(4,5)22(33)11-14-34(23,36)7)47-29-28(48-49(43,44)45)27(38)26(37)20(3)46-29/h8,18-20,22-29,37-38H,9-17H2,1-7H3,(H,39,40)(H,41,42)(H,43,44,45)/t18-,19+,20-,22+,23-,24+,25+,26-,27+,28-,29+,33+,34-,35+,36-/m1/s1
InChIKey WSMJRNOZKLNLOR-DLCGLXBKSA-N
Mol Weight 712.9 g/mol
Molecular Formula C36H56O12S
Exact Mass 712.349248 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7qRzou0cQAm
Name ZYGOPHYLOSIDE-D;3-O-[BETA-D-2-O-SULPHONYL-QUINOVOPYRANOSYL]-QUINOVIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H56O12S
InChI InChI=1S/C36H56O12S/c1-18-10-15-35(30(39)40)16-17-36(31(41)42)21(25(35)19(18)2)8-9-23-33(6)13-12-24(32(4,5)22(33)11-14-34(23,36)7)47-29-28(48-49(43,44)45)27(38)26(37)20(3)46-29/h8,18-20,22-29,37-38H,9-17H2,1-7H3,(H,39,40)(H,41,42)(H,43,44,45)/t18-,19+,20-,22+,23-,24+,25+,26-,27+,28-,29+,33+,34-,35+,36-/m1/s1
InChIKey WSMJRNOZKLNLOR-DLCGLXBKSA-N
Literature Reference Author V.U.AHMAD,X.GHAZALA,S.UDDIN,M.S.ALI
Literature Reference Citation PHYTOCHEM.,33,453(1993)
Literature Reference DOI 10.1016/0031-9422(93)85538-3
Molecular Weight 712.893 g/mol
Solvent CD3OD
Source File Reference UWVN6424