(Q105217783)

English

methyl (13E)-18-[(acetyloxy)methyl]-13-ethylidene-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate

group of stereoisomers with the chemical formula C₂₃H₂₆N₂O₄

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Statements

group of stereoisomers

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akuammiline alkaloid

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akuammiline alkaloid

394.189257312 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₃H₂₆N₂O₄

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canonical SMILES

O=C(OCC1(C(=O)OC)C2C(=CC)CN3CCC41C=5C=CC=CC5N=C4C3C2)C

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isomeric SMILES

C/C=C1/CN2CCC34C(=Nc5ccccc53)C2CC1C4(COC(C)=O)C(=O)OC

1 reference

based on heuristic

inferred from InChI

Identifiers

InChI=1S/C23H26N2O4/c1-4-15-12-25-10-9-22-16-7-5-6-8-18(16)24-20(22)19(25)11-17(15)23(22,21(27)28-3)13-29-14(2)26/h4-8,17,19H,9-13H2,1-3H3/b15-4-

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QBHALCZZZWCCLV-TVPGTPATSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

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