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NIGROSIDE_1;6-O-(3''-O-CINNAMOYL-ALPHA-L-RHAMNOPYRANOSYL)-AUCUBIN
SpectraBase Compound ID A0Np8lccYVc
InChI InChI=1S/C30H38O14/c1-14-22(34)27(43-20(33)8-7-15-5-3-2-4-6-15)26(38)30(40-14)41-18-11-16(12-31)21-17(18)9-10-39-28(21)44-29-25(37)24(36)23(35)19(13-32)42-29/h2-11,14,17-19,21-32,34-38H,12-13H2,1H3/b8-7+/t14-,17+,18-,19+,21-,22-,23+,24-,25+,26+,27+,28+,29-,30-/m1/s1
InChIKey RUFZYMSKBXORQX-WMKOSVJXSA-N
Mol Weight 622.6 g/mol
Molecular Formula C30H38O14
Exact Mass 622.226156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5LyGolkrEs7
Name NIGROSIDE_1;6-O-(3''-O-CINNAMOYL-ALPHA-L-RHAMNOPYRANOSYL)-AUCUBIN
Compound Number 70
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H38O14
InChI InChI=1S/C30H38O14/c1-14-22(34)27(43-20(33)8-7-15-5-3-2-4-6-15)26(38)30(40-14)41-18-11-16(12-31)21-17(18)9-10-39-28(21)44-29-25(37)24(36)23(35)19(13-32)42-29/h2-11,14,17-19,21-32,34-38H,12-13H2,1H3/b8-7+/t14-,17+,18-,19+,21-,22-,23+,24-,25+,26+,27+,28+,29-,30-/m1/s1
InChIKey RUFZYMSKBXORQX-WMKOSVJXSA-N
Literature Reference Author C.A.BOROS,F.R.STERMITZ
Literature Reference Citation J.NAT.PROD.,53,1055(1990)
Literature Reference DOI 10.1021/np50071a001
Molecular Weight 622.623 g/mol
Solvent CD3OD
Source File Reference UWMZ16064