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LAETIPOSIDE-A
SpectraBase Compound ID IYN0oAWwlzU
InChI InChI=1S/C37H60O9/c1-19(2)20(3)9-10-21(32(43)44)22-11-16-37(8)28-23(12-15-36(22,37)7)35(6)14-13-27(39)34(4,5)26(35)17-24(28)45-33-31(42)30(41)29(40)25(18-38)46-33/h19,21-22,24-27,29-31,33,38-42H,3,9-18H2,1-2,4-8H3,(H,43,44)/t21?,22-,24-,25-,26+,27+,29-,30+,31-,33-,35-,36-,37+/m1/s1
InChIKey VWMVCDKDDCSCQH-RSPZHWGZSA-N
Mol Weight 648.9 g/mol
Molecular Formula C37H60O9
Exact Mass 648.423734 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AXbwqmIuEVp
Name LAETIPOSIDE-A
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H60O9
InChI InChI=1S/C37H60O9/c1-19(2)20(3)9-10-21(32(43)44)22-11-16-37(8)28-23(12-15-36(22,37)7)35(6)14-13-27(39)34(4,5)26(35)17-24(28)45-33-31(42)30(41)29(40)25(18-38)46-33/h19,21-22,24-27,29-31,33,38-42H,3,9-18H2,1-2,4-8H3,(H,43,44)/t21?,22-,24-,25-,26+,27+,29-,30+,31-,33-,35-,36-,37+/m1/s1
InChIKey VWMVCDKDDCSCQH-RSPZHWGZSA-N
Literature Reference Author K.YOSHIKAWA,K.MATSUMOTO,S.ARIHARA
Literature Reference Citation J.NAT.PROD.,62,543(1999)
Literature Reference DOI 10.1021/np980456i
Molecular Weight 648.878 g/mol
Solvent PYRIDINE
Source File Reference UWGE1221