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6'-O-[(2R)-METHYL-3-VERATROYLOXYPROPANOYL]-7-ALPHA-MORRONISIDE
SpectraBase Compound ID Ht7Q8qaspD4
InChI InChI=1S/C30H40O16/c1-13(10-41-27(36)15-6-7-18(38-3)19(8-15)39-4)26(35)42-12-20-23(32)24(33)25(34)30(45-20)46-29-22-14(2)44-21(31)9-16(22)17(11-43-29)28(37)40-5/h6-8,11,13-14,16,20-25,29-34H,9-10,12H2,1-5H3/t13-,14+,16?,20-,21-,22?,23-,24+,25-,29+,30+/m1/s1
InChIKey SAMZEMVEJYCIEE-WXOHZLAVSA-N
Mol Weight 656.6 g/mol
Molecular Formula C30H40O16
Exact Mass 656.231635 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7RjCGZq3whp
Name 6'-O-[(2R)-METHYL-3-VERATROYLOXYPROPANOYL]-7-ALPHA-MORRONISIDE
Compound Number 180
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H40O16
InChI InChI=1S/C30H40O16/c1-13(10-41-27(36)15-6-7-18(38-3)19(8-15)39-4)26(35)42-12-20-23(32)24(33)25(34)30(45-20)46-29-22-14(2)44-21(31)9-16(22)17(11-43-29)28(37)40-5/h6-8,11,13-14,16,20-25,29-34H,9-10,12H2,1-5H3/t13-,14+,16?,20-,21-,22?,23-,24+,25-,29+,30+/m1/s1
InChIKey SAMZEMVEJYCIEE-WXOHZLAVSA-N
Literature Reference Author C.A.BOROS,F.R.STERMITZ
Literature Reference Citation J.NAT.PROD.,54,1173(1991)
Literature Reference DOI 10.1021/np50077a001
Molecular Weight 656.638 g/mol
Solvent CD3OD
Source File Reference UWCS4551