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14-BETA-O-(2-S,3-S-NILYL)-2-ALPHA,3-BETA,5-BETA,6-BETA,16-ALPHA-PENTAHYDROXYGRAYAN-10-(20)-ENE
SpectraBase Compound ID APrjc3YxVe8
InChI InChI=1S/C25H40O8/c1-11(13(3)26)21(30)33-20-15-8-7-14-12(2)17-18(28)19(29)22(4,5)25(17,32)16(27)9-24(14,20)10-23(15,6)31/h11,13-20,26-29,31-32H,2,7-10H2,1,3-6H3/t11?,13?,14-,15+,16+,17+,18+,19-,20+,23+,24-,25+/m0/s1
InChIKey WZAGICLCYMETRE-MFTYSLHZSA-N
Mol Weight 468.6 g/mol
Molecular Formula C25H40O8
Exact Mass 468.272318 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9IOm4d3hab0
Name 14-BETA-O-(2-S,3-S-NILYL)-2-ALPHA,3-BETA,5-BETA,6-BETA,16-ALPHA-PENTAHYDROXYGRAYAN-10-(20)-ENE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H40O8
InChI InChI=1S/C25H40O8/c1-11(13(3)26)21(30)33-20-15-8-7-14-12(2)17-18(28)19(29)22(4,5)25(17,32)16(27)9-24(14,20)10-23(15,6)31/h11,13-20,26-29,31-32H,2,7-10H2,1,3-6H3/t11?,13?,14-,15+,16+,17+,18+,19-,20+,23+,24-,25+/m0/s1
InChIKey WZAGICLCYMETRE-MFTYSLHZSA-N
Literature Reference Author X.Z.HUANG,Y.H.WANG,S.S.YU,G.M.FU,Y.C.HU,Y.LIU,L.H.FAN
Literature Reference Citation J.NAT.PROD.,68,1646(2005)
Literature Reference DOI 10.1021/np050261s
Molecular Weight 468.588 g/mol
Solvent C5D5N
Source File Reference UWMZ13091