Description
IUPAC Name: (1R,5S,6S,7S,8S)-2-ethenyl-1′-methoxy-4-methylspiro[9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane-7,3′-indole]-2′-one
InChI: InChI=1S/C21H24N2O3/c1-4-20-11-22(2)17-12-10-26-16(9-14(12)20)21(18(17)20)13-7-5-6-8-15(13)23(25-3)19(21)24/h4-8,12,14,16-18H,1,9-11H2,2-3H3/t12?,14-,16+,17-,18+,20?,21+/m1/s1
InChIKey: SSSCMFCWHWCCEH-LGUFPRDESA-N
Canonical SMILES: CN1CC2(C3CC4C5(C2C1C3CO4)C6=CC=CC=C6N(C5=O)OC)C=C
Isomeric SMILES: CN1CC2([C@@H]3C[C@H]4[C@]5([C@H]2[C@H]1C3CO4)C6=CC=CC=C6N(C5=O)OC)C=C
Synonyms: Gelsevirine; 38990-03-3; Gelsemine, 1-methoxy-; (1R,5S,6S,7S,8S)-2-ethenyl-1′-methoxy-4-methylspiro[9-oxa-4-azatetracyclo[6.3.1.02,6.05,11]dodecane-7,3′-indole]-2′-one; DTXSID70959834; 1ST169511; D85052; Spiro(3,5,8-ethanylylidene-1H-pyrano(3,4-c)pyridine-10,3′-(3H)indol)-2′(1’H)-one, 5-ethenyl-3,4,4a,5,6,7,8,8a-octahydro-1′-methoxy-7-methyl-, (3R,3’S,4aR,5S,8S,8aS,9S)-
Botanical Source: