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KOMAROVESIDE-A;(3S,4R,5Z,7E)-3,4-DIHYDROXY-5,7-MEGASTIGMADIEN-9-ONE-3-O-BETA-D-GLUCOPYRANOSIDE
SpectraBase Compound ID L2XPdWlSupS
InChI InChI=1S/C19H30O8/c1-9(21)5-6-11-10(2)14(22)12(7-19(11,3)4)26-18-17(25)16(24)15(23)13(8-20)27-18/h5-6,12-18,20,22-25H,7-8H2,1-4H3/b6-5+/t12-,13+,14+,15+,16-,17+,18+/m0/s1
InChIKey BLQCWBCWZFDGBW-WQYRLUMKSA-N
Mol Weight 386.44 g/mol
Molecular Formula C19H30O8
Exact Mass 386.194068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KGclUAyFmZB
Name KOMAROVESIDE-A;(3S,4R,5Z,7E)-3,4-DIHYDROXY-5,7-MEGASTIGMADIEN-9-ONE-3-O-BETA-D-GLUCOPYRANOSIDE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H30O8
InChI InChI=1S/C19H30O8/c1-9(21)5-6-11-10(2)14(22)12(7-19(11,3)4)26-18-17(25)16(24)15(23)13(8-20)27-18/h5-6,12-18,20,22-25H,7-8H2,1-4H3/b6-5+/t12-,13+,14+,15+,16-,17+,18+/m0/s1
InChIKey BLQCWBCWZFDGBW-WQYRLUMKSA-N
Literature Reference Author I.K.LEE,K.H.KIM,S.Y.LEE,S.U.CHOI,K.R.LEE
Literature Reference Citation CHEM.PHARM.BULL.,59,773(2011)
Literature Reference DOI 10.1248/cpb.59.773
Molecular Weight 386.442 g/mol
Source File Reference UWIR3209