(Q105215057)

English

[(1S,2S,4S,9S,10R)-14-Oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-4-yl] (E)-3-phenylprop-2-enoate

chemical compound

In more languages

Statements

type of chemical entity

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quinolizidine alkaloid

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394.22564282 dalton

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based on heuristic

inferred from SMILES

stereoisomer of

[(1S,2S,4S,9S,10R)-14-oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-4-yl] 3-phenylprop-2-enoate

1 reference

based on heuristic

inferred from InChIKey

[(1R,2S,4S,9R,10R)-14-oxo-7,15-diazatetracyclo[7.7.1.02,7.010,15]heptadecan-4-yl] (E)-3-phenylprop-2-enoate

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₃₀N₂O₃

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canonical SMILES

O=C(OC1CCN2CC3CC(CN4C(=O)CCCC43)C2C1)C=CC=5C=CC=CC5

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isomeric SMILES

O=C(/C=C/c1ccccc1)O[C@H]1CCN2C[C@@H]3C[C@@H](CN4C(=O)CCC[C@H]34)[C@@H]2C1

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1 reference

Alkaloids of Rothia trifoliata and Rothia hirsuta

Lupinus lanatus

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Quinolizidine alkaloids from Lupinus lanatus

has characteristic

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Identifiers

InChI=1S/C24H30N2O3/c27-23-8-4-7-21-18-13-19(16-26(21)23)22-14-20(11-12-25(22)15-18)29-24(28)10-9-17-5-2-1-3-6-17/h1-3,5-6,9-10,18-22H,4,7-8,11-16H2/b10-9+/t18-,19-,20-,21+,22-/m0/s1

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PUFYZCKVLOYPHL-MFYPYBFPSA-N

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CAS Registry Number

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CAS (formerly Chemical Abstracts Service)

25 January 2022

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26 December 2021

UniChem compound ID

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