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20S-PROTOPANAXADIOL
SpectraBase Compound ID NEPF2DA1Cc
InChI InChI=1S/C30H52O3/c1-19(2)10-9-14-30(8,33)20-11-16-29(7)25(20)21(31)18-23-27(5)15-13-24(32)26(3,4)22(27)12-17-28(23,29)6/h10,20-25,31-33H,9,11-18H2,1-8H3/t20-,21+,22-,23+,24-,25-,27-,28+,29+,30+/m0/s1
InChIKey PYXFVCFISTUSOO-VUFVRDRTSA-N
Mol Weight 460.7 g/mol
Molecular Formula C30H52O3
Exact Mass 460.391646 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7f4A8k9oivf
Name 20-(S)-PROTOPANAXADIOL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H52O3
InChI InChI=1S/C30H52O3/c1-19(2)10-9-14-30(8,33)20-11-16-29(7)25(20)21(31)18-23-27(5)15-13-24(32)26(3,4)22(27)12-17-28(23,29)6/h10,20-25,31-33H,9,11-18H2,1-8H3/t20-,21+,22-,23+,24-,25-,27-,28+,29+,30+/m0/s1
InChIKey PYXFVCFISTUSOO-VUFVRDRTSA-N
Literature Reference Author Y.USAMI,Y.N.LIU,A.S.LIN,M.SHIBANO,T.AKIYAMA,H.ITOKAWA,S.L.MO RRIS-NATSCHKE,K.BAST
Literature Reference Citation J.NAT.PROD.,71,478(2008)
Literature Reference DOI 10.1021/np070613q
Molecular Weight 460.741 g/mol
Sample ID 27510
Solvent C5D5N