(Q117835377)

English

N demethylechitamine

group of stereoisomers with the chemical formula C₂₃H₂₈N₂O₄

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Statements

group of stereoisomers

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chemical compound

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396.204907376 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₂₃H₂₈N₂O₄

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canonical SMILES

O=C(OC)C1(CO)C2C(=CC)CN3C(C4=C(C=5C=C(OC)C=CC5N4C)CC31)C2

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isomeric SMILES

C/C=C1\CN2[C@H]3Cc4c(n(C)c5ccc(OC)cc45)[C@@H]2C[C@@H]1C3(CO)C(=O)OC

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Alstonia lanceolifera

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Alcaloides d'Alstonia lanceolifera

Identifiers

InChI=1S/C23H28N2O4/c1-5-13-11-25-19-10-17(13)23(12-26,22(27)29-4)20(25)9-16-15-8-14(28-3)6-7-18(15)24(2)21(16)19/h5-8,17,19-20,26H,9-12H2,1-4H3/b13-5+/t17-,19-,20-,23?/m0/s1

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YRBCHUQDMNLZSV-UMLQZVKESA-N

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