(Q105146457)

English

methyl (1R,4S,12S,13S,16R,19S)-19-hydroxy-7,8-dimethoxy-15,18-dioxo-17-oxa-5,14-diazaheptacyclo[12.6.3.01,13.04,12.04,19.06,11.012,16]tricosa-6(11),7,9-triene-5-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

aspidospermine / aspidofractine / kopsane alkaloid

0 references

mass

470.168915792 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₄H₂₆N₂O₈

0 references

canonical SMILES

O=C(OC)N1C2=C(OC)C(OC)=CC=C2C34C5OC(=O)C6(O)CC7(CCCN(C5=O)C37)CCC164

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isomeric SMILES

COC(=O)N1c2c(ccc(OC)c2OC)[C@]23[C@H]4N5CCC[C@]46CC[C@]12[C@@](O)(C6)C(=O)O[C@H]3C5=O

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found in taxon

Kopsia arborea

1 reference

stated in

Biologically active indole alkaloids from Kopsia arborea

Kopsia pauciflora

1 reference

stated in

A comprehensive review on phytochemistry and pharmacology of genus Kopsia: monoterpene alkaloids – major secondary metabolites

Identifiers

InChI

InChI=1S/C24H26N2O8/c1-31-13-6-5-12-14(15(13)32-2)26(20(29)33-3)23-9-8-21-7-4-10-25-17(27)16(24(12,23)18(21)25)34-19(28)22(23,30)11-21/h5-6,16,18,30H,4,7-11H2,1-3H3/t16-,18-,21+,22+,23+,24-/m0/s1

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InChIKey

KVCMSSAYBDEFDL-FGXAQCGJSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

KVCMSSAYBDEFDL-FGXAQCGJSA-N

(Q105146457)

methyl (1R,4S,12S,13S,16R,19S)-19-hydroxy-7,8-dimethoxy-15,18-dioxo-17-oxa-5,14-diazaheptacyclo[12.6.3.01,13.04,12.04,19.06,11.012,16]tricosa-6(11),7,9-triene-5-carboxylate

Statements

Identifiers

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