(Q105180654)

English

methyl (1R,9R,10R,13E,14R,15R)-13-ethylidene-11-formyl-18-oxa-8,11-diazapentacyclo[7.6.3.110,14.01,9.02,7]nonadeca-2,4,6-triene-15-carboxylate

chemical compound

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Statements

instance of

type of chemical entity

0 references

1 reference

methyl (13E)-13-ethylidene-11-formyl-18-oxa-8,11-diazapentacyclo[7.6.3.1¹⁰,¹⁴.0¹,⁹.0²,⁷]nonadeca-2,4,6-triene-15-carboxylate

1 reference

based on heuristic

inferred from SMILES

mass

368.173607248 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

methyl (1R,9R,10S,13E,14R,15R)-13-ethylidene-11-formyl-18-oxa-8,11-diazapentacyclo[7.6.3.110,14.01,9.02,7]nonadeca-2,4,6-triene-15-carboxylate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₄N₂O₄

0 references

canonical SMILES

O=CN1CC(=CC)C2CC1C34OCCC4(C=5C=CC=CC5N3)C2C(=O)OC

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isomeric SMILES

C/C=C1/CN(C=O)[C@@H]2C[C@@H]1[C@@H](C(=O)OC)[C@@]13CCO[C@@]21Nc1ccccc13

0 references

found in taxon

Kopsia singapurensis

1 reference

stated in

Biologically active aspidofractinine, rhazinilam, akuammiline, and vincorine alkaloids from Kopsia

Identifiers

InChI

InChI=1S/C21H24N2O4/c1-3-13-11-23(12-24)17-10-14(13)18(19(25)26-2)20-8-9-27-21(17,20)22-16-7-5-4-6-15(16)20/h3-7,12,14,17-18,22H,8-11H2,1-2H3/b13-3-/t14-,17+,18-,20-,21-/m0/s1

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InChIKey

NKMFTVSMLXLPDB-MEEWKOTDSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

NKMFTVSMLXLPDB-MEEWKOTDSA-N

(Q105180654)

methyl (1R,9R,10R,13E,14R,15R)-13-ethylidene-11-formyl-18-oxa-8,11-diazapentacyclo[7.6.3.110,14.01,9.02,7]nonadeca-2,4,6-triene-15-carboxylate

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