Aspidospermidine-3-carboxylic acid, 6,7-didehydro-3,4-dihydroxy-16-methoxy-1-methyl-, methyl ester, (2β,3β,4β,5α,12R,19α)-
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Aspidospermidine-3-carboxylic acid, 6,7-didehydro-3,4-dihydroxy-16-methoxy-1-methyl-, methyl ester, (2β,3β,4β,5α,12R,19α)-
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CAS No:
3633-92-9
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Formula:
C23H30N2O5
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Chemical Name:
Aspidospermidine-3-carboxylic acid, 6,7-didehydro-3,4-dihydroxy-16-methoxy-1-methyl-, methyl ester, (2β,3β,4β,5α,12R,19α)-
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Synonyms:
Aspidospermidine-3-carboxylic acid,6,7-didehydro-3,4-dihydroxy-16-methoxy-1-methyl-,methyl ester,(2β,3β,4β,5α,12R,19α)-;Vindoline,deacetyl-;Aspidospermidine-3-carboxylic acid,6,7-didehydro-3,4-dihydroxy-16-methoxy-1-methyl-,methyl ester,(2β,3β,4β,5α,12β,19α)-;1H-Indolizino[8,1-cd]carbazole,aspidospermidine-3-carboxylic acid deriv.;Deacetylvindoline;Desacetylvindoline;NSC 91993;4-Desacetylvindoline
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CAS No:
Description
White Solid
17-O-deacetylvindoline is a vinca alkaloid that is vindoline in which the acetate ester group at position 17 has been hydrolysed to give the corresponding secondary alcohol. It is a vinca alkaloid, an organic heteropentacyclic compound, a methyl ester, a tertiary alcohol and a secondary alcohol. It derives from a vindoline. It is a conjugate base of a 17-O-deacetylvindolinium.
Aspidospermidine-3-carboxylic acid, 6,7-didehydro-3,4-dihydroxy-16-methoxy-1-methyl-, methyl ester, (2β,3β,4β,5α,12R,19α)- Basic Attributes
414.4947
414.49
91993
Aspidospermidine-3-carboxylic acid, 6,7-didehydro-3,4-dihydroxy-16-methoxy-1-methyl-, methyl ester, (2β,3β,4β,5α,12R,19α)- Use and Manufacturing
Precursor to Vindoline during Vincristine biosynthesis.
Computed Properties
Molecular Weight:414.5
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:414.21547206
Monoisotopic Mass:414.21547206
Topological Polar Surface Area:82.5
Heavy Atom Count:30
Complexity:760
Defined Atom Stereocenter Count:6
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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