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VITEXTRIFOLIN_A;(REL-3-S,5-S,8-R,9-R,10-S,13-S,15-S,16-R)-3-ACETOXY-9,13;15,16-DIEPOXY-15,16-DIMETHOXYLABDANE
SpectraBase Compound ID 5JkpXo27b3z
InChI InChI=1S/C24H40O6/c1-15-8-9-17-21(3,4)18(28-16(2)25)10-11-22(17,5)24(15)13-12-23(30-24)14-19(26-6)29-20(23)27-7/h15,17-20H,8-14H2,1-7H3/t15-,17+,18+,19+,20-,22+,23-,24-/m1/s1
InChIKey LGITXCALUZAZQD-PVYBQKNGSA-N
Mol Weight 424.6 g/mol
Molecular Formula C24H40O6
Exact Mass 424.282489 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HJlLK3kKk5m
Name VITEXTRIFOLIN_A;(REL-3-S,5-S,8-R,9-R,10-S,13-S,15-S,16-R)-3-ACETOXY-9,13;15,16-DIEPOXY-15,16-DIMETHOXYLABDANE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H40O6
InChI InChI=1S/C24H40O6/c1-15-8-9-17-21(3,4)18(28-16(2)25)10-11-22(17,5)24(15)13-12-23(30-24)14-19(26-6)29-20(23)27-7/h15,17-20H,8-14H2,1-7H3/t15-,17+,18+,19+,20-,22+,23-,24-/m1/s1
InChIKey LGITXCALUZAZQD-PVYBQKNGSA-N
Literature Reference Author C.J.ZHENG,J.Y.ZHU,W.YU,X.Q.MA,K.RAHMAN,L.P.QIN
Literature Reference Citation J.NAT.PROD.,76,287(2013)
Literature Reference DOI 10.1021/np300679x
Molecular Weight 424.578 g/mol
Sample ID 42232
Solvent CDCl3