Description
IUPAC Name: (1S,2S,4S,7Z,8S,9S)-7-ethylidene-1′,6′-dimethoxyspiro[11-oxa-5-azatricyclo[6.3.1.04,9]dodecane-2,3′-indole]-2′-one
InChI: InChI=1S/C21H26N2O4/c1-4-12-10-22-17-9-21(19-8-14(12)15(17)11-27-19)16-6-5-13(25-2)7-18(16)23(26-3)20(21)24/h4-7,14-15,17,19,22H,8-11H2,1-3H3/b12-4+/t14-,15+,17+,19+,21+/m1/s1
InChIKey: ZORKKCARNQAZRJ-YHEJMRRESA-N
Canonical SMILES: CC=C1CNC2CC3(C4CC1C2CO4)C5=C(C=C(C=C5)OC)N(C3=O)OC
Isomeric SMILES: C/C=C/1CN[C@H]2C[C@@]3([C@@H]4C[C@H]1[C@@H]2CO4)C5=C(C=C(C=C5)OC)N(C3=O)OC
Synonyms: Humantenirine; 82375-30-2; Humantenine, 4-demethyl-11-methoxy-; (1S,2S,4S,7Z,8S,9S)-7-Ethylidene-1′,6′-dimethoxyspiro[11-oxa-5-azatricyclo[6.3.1.04,9]dodecane-2,3′-indole]-2′-one; D85051
Botanical Source: Gelsemium elegans