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Pervilleine D

View entire compound with spectra: 1 MS (GC)

Pervilleine D
SpectraBase Compound ID NBMwsWiGwD
InChI InChI=1S/C32H39NO11/c1-33-21-16-20(43-27(34)10-8-18-12-23(37-2)31(41-6)24(13-18)38-3)17-22(33)30(29(21)36)44-28(35)11-9-19-14-25(39-4)32(42-7)26(15-19)40-5/h8-15,20-22,29-30,36H,16-17H2,1-7H3/b10-8+,11-9+/t20-,21+,22-,29-,30+/m1/s1
InChIKey GYERRJFXENPCTB-OXJWFONESA-N
Mol Weight 613.7 g/mol
Molecular Formula C32H39NO11
Exact Mass 613.252311 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40N2A2y9r0m
Name Pervilleine D
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H39NO11
InChI InChI=1S/C32H39NO11/c1-33-21-16-20(43-27(34)10-8-18-12-23(37-2)31(41-6)24(13-18)38-3)17-22(33)30(29(21)36)44-28(35)11-9-19-14-25(39-4)32(42-7)26(15-19)40-5/h8-15,20-22,29-30,36H,16-17H2,1-7H3/b10-8+,11-9+/t20-,21+,22-,29-,30+/m1/s1
InChIKey GYERRJFXENPCTB-OXJWFONESA-N
Molecular Weight 613.660 g/mol
SMILES O[C@@]1([C@]2(N([C@@]([C@@]1(OC(\C=C\c1cc(OC)c(c(c1)OC)OC)=O)[H])(C[C@@](C2)(OC(\C=C\c1cc(OC)c(c(c1)OC)OC)=O)[H])[H])C)[H])[H]
SPLASH splash10-000i-0961000000-f9807f51474c50ed6cf1
Source of Spectrum G4-64-1519-7
Synonyms (3R,6R,7S)-6-hydroxy-8-methyl-7-{[(2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoyl]oxy}-8-azabicyclo[3.2.1]oct-3-yl (2E)-3-(3,4,5-trimethoxyphenyl)-2-propenoate (E)-3-(3,4,5-trimethoxyphenyl)-2-propenoic acid[(3R,6S,7R)-7-hydroxy-8-methyl-6-[(E)-1-oxo-3-(3,4,5-trimethoxyphenyl)prop-2-enoxy]-8-azabicyclo[3.2.1]octan-3-yl]ester (E)-3-(3,4,5-trimethoxyphenyl)acrylic acid[(3R,6S,7R)-7-hydroxy-8-methyl-6-[(E)-3-(3,4,5-trimethoxyphenyl)acryloyl]oxy-8-azabicyclo[3.2.1]octan-3-yl]ester 3.alpha.,6.beta.-bis[(3',4',5'-Trimethoxycinnamoyl)oxy]-7.beta.-hydroxytropane [(3R,6S,7R)-7-hydroxy-8-methyl-6-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy-8-azabicyclo[3.2.1]octan-3-yl](E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate [(3R,6S,7R)-8-methyl-7-oxidanyl-6-[(E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy-8-azabicyclo[3.2.1]octan-3-yl](E)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
Wiley ID 1609347