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deacetylvindoline
SpectraBase Compound ID CITQ0zOcLjr
InChI InChI=1S/C23H30N2O5/c1-5-21-9-6-11-25-12-10-22(17(21)25)15-8-7-14(29-3)13-16(15)24(2)18(22)23(28,19(21)26)20(27)30-4/h6-9,13,17-19,26,28H,5,10-12H2,1-4H3
InChIKey ZDKMPOJNYNVYLA-UHFFFAOYSA-N
Mol Weight 414.5 g/mol
Molecular Formula C23H30N2O5
Exact Mass 414.215472 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36YHE2wXPmB
Name deacetylvindoline
CAS Registry Number 3633-92-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30N2O5
InChI InChI=1S/C23H30N2O5/c1-5-21-9-6-11-25-12-10-22(17(21)25)15-8-7-14(29-3)13-16(15)24(2)18(22)23(28,19(21)26)20(27)30-4/h6-9,13,17-19,26,28H,5,10-12H2,1-4H3
InChIKey ZDKMPOJNYNVYLA-UHFFFAOYSA-N
Molecular Weight 414.502 g/mol
SMILES OC1C2(C3C4(C(C1(C(OC)=O)O)N(c1c4ccc(c1)OC)C)CCN3CC=C2)CC
SPLASH splash10-01w3-0930200000-52cfbfadb21e31b49a72
Source of Spectrum J-52-352-35
Synonyms Vindoline, deacetyl- Desacetylvindoline Methyl 3,4-dihydroxy-16-methoxy-1-methyl-6,7-didehydroaspidospermidine-3-carboxylate NSC 91993
Wiley ID 1375434