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InChIKey | CUHFIPBCFIPFJM-JXSBNBLESA-O |
InChI | InChI=1S/C21H22N2O3/c1-3-13-11-23-9-8-15-14-6-4-5-7-18(14)22-20(15)19(23)10-16(13)17(12-24)21(25)26-2/h3-7,11-12,16,19,22H,8-10H2,1-2H3/p+1/b13-3-/t16-,19-/m0/s1 |
SMILES | COC(=O)C(=C/O)\[C@H]1C[C@H]2c3[nH]c4ccccc4c3CC[N+]2=C\C1=C\C |
#reac | |
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Distinct reactions in my sandbox | 0 |
Distinct generic reactions in MNXref | 9 |
Distinct compatimentalized reactions in models | 0 |
Identifier | Description |
---|---|
chebi:17294 | 4,21-dehydrogeissoschizine 4,21-Dehydrogeissoschizine methyl (19E)-16-(hydroxymethylidene)-4,21-didehydrocoryn-19-en-4-ium-17-oate methyl (19E)-16-(hydroxymethylidene)coryna-4(21),19-dien-4-ium-17-oate |
keggC:C03677 | 4,21-Dehydrogeissoschizine |
metacycM:421-DEHYDROGEISSOSCHIZINE | 4,21-dehydrogeissoschizine |
chebi:11918 chebi:1738 chebi:20259 chebi:58094 keggC:M_C03677 seedM:M_cpd02308 | secondary/obsolete/fantasy identifier |
seedM:cpd02308 | 4,21-Dehydrogeissoschizine 4,21-dehydrogeissoschizine |