(Q105267650)

English

methyl (1S,15E,18S)-15-ethylidene-17-methyl-12-oxo-10,17-diazatetracyclo[12.3.1.0³,¹¹.0⁴,⁹]octadeca-3(11),4,6,8-tetraene-18-carboxylate

group of stereoisomers with the chemical formula C₂₁H₂₄N₂O₃

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Statements

group of stereoisomers

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vobasine alkaloid

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vobasine alkaloid

352.1786926279999 dalton

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based on heuristic

inferred from isomeric SMILES

chemical formula

C₂₁H₂₄N₂O₃

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canonical SMILES

O=C(OC)C1C2C(=CC)CN(C)C1CC=3C=4C=CC=CC4NC3C(=O)C2

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isomeric SMILES

C/C=C1/CN(C)[C@H]2Cc3c([nH]c4ccccc34)C(=O)CC1[C@@H]2C(=O)OC

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Identifiers

InChI=1S/C21H24N2O3/c1-4-12-11-23(2)17-9-15-13-7-5-6-8-16(13)22-20(15)18(24)10-14(12)19(17)21(25)26-3/h4-8,14,17,19,22H,9-11H2,1-3H3/b12-4-/t14?,17-,19-/m0/s1

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TYPMTMPLTVSOBU-UKXSANAWSA-N

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