| 2D Structure | |
| CID | 442021 |
| IUPAC Name | (4aR,5aS,8aR,13aS,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one |
| InChI | InChI=1S/C23H26N2O4/c1-27-16-8-14-15(9-17(16)28-2)25-20(26)10-18-21-13-7-19-23(14,22(21)25)4-5-24(19)11-12(13)3-6-29-18/h3,8-9,13,18-19,21-22H,4-7,10-11H2,1-2H3/t13-,18-,19-,21-,22-,23+/m0/s1 |
| InChI Key | RRKTZKIUPZVBMF-IBTVXLQLSA-N |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C23H26N2O4 |
| Molecular Weight | 394.5 |
| synonyms | ['BRUCINE', '357-57-3', '10,11-Dimethoxystrychnine', 'Brucinum', '2,3-Dimethoxystrychnine', '(-)-Brucine', '2,3-Dimethoxystrychnidin-10-one', 'Bruzin', 'l-Brucine', 'Brucine alkaloid', 'Strychnidin-10-one, 2,3-dimethoxy-', '10,11-Dimethystrychnine', 'Brucina', 'DTXSID2024662', '2,3-Dimethoxy-strychnine', '6NG17YCK6H', 'Strychnine, 2,3-dimethoxy-', 'Dimethoxy strychnine', 'NSC-757797', 'DTXCID204662', 'dimethoxystrychnine', '(4aR,5aS,8aR,13aS,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one', '(1R,11S,18S,20R,21R,22S)-4,5-dimethoxy-12-oxa-8,17-diazaheptacyclo(15.5.2.0^(1,18).0^(2,7).0^(8,22).0^(11,21).0^(15,20))tetracosa-2(7),3,5,14-tetraen-9-one', '(1R,11S,18S,20R,21R,22S)-4,5-dimethoxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0^{1,18}.0^{2,7}.0^{8,22}.0^{11,21}.0^{15,20}]tetracosa-2(7),3,5,14-tetraen-9-one', '(4aR,5aS,8aR,13aS,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo(3,2,1-ij)oxepino(2,3,4-de)pyrrolo(2,3-h)quinolin-14-one', '(4aR,5aS,8aR,13aS,15aS,15bR)-10,11-dimethoxy-4a,5,5a,7,8,13a,15,15a,15b,16-decahydro-2H-4,6-methanoindolo(3,2,1-ij)oxepino(2,3,4-de)pyrrolo(2,3-h)quinoline-14-one', 'RefChem:917651', '206-614-7', '4,5-dimethoxy-12-oxa-8,17-diazaheptacyclo(15.5.2.01,18.02,7.08,22.011,21.015,20)tetracosa-2(7),3,5,14-tetraen-9-one', 'Brucine, Anhydrous', 'C23H26N2O4', 'RCRA waste number P018', 'Brucine Anhydrous', 'Brucin [German]', 'Brucina [Italian]', 'CAS-357-57-3', 'SMR000112281', 'UNII-6NG17YCK6H', '10,11-dimethoxy strychnine', 'CCRIS 4754', 'HSDB 307', 'anhydrous brucine', 'Bisdesmethylbrucin', 'Brucine CRS', 'UN 1570', 'NCGC00094861-01', 'EINECS 206-614-7', 'UN1570', 'BRUCINE [VANDF]', 'BRUCINUM [HPUS]', 'BRUCINE [HSDB]', 'BRUCINE [MI]', 'RCRA waste no. P018', 'Brucine, anhydrous, 98%', 'BRUCINE [NFLIS-DRUG]', 'GTPL342', 'MLS000515808', 'MLS001424166', 'orb105214', 'SCHEMBL113229', 'CHEBI:3193', 'CHEMBL501756', 'MEGxp0_001865', 'SCHEMBL29391712', 'ACon1_001990', 'Brucine [UN1570] [Poison]', 'HMS2052O03', 'HMS2268L16', 'MSK23017', 'Tox21_111349', 'Tox21_302174', '10,11-Dimethoxystrychnine Anhydrous', 'BDBM50401037', 'MFCD00149384', 'NSC833996', 'AKOS015955678', 'AKOS024282466', 'CCG-101078', 'EBC-605475', 'FB19344', 'NC00328', 'NSC 757797', 'NSC-833996', 'NCGC00255253-01', 'NCGC00263445-01', 'NCGC00263445-02', 'NCGC00384497-01', '2,3-Dimethoxystrychnidin-10-one Anhydrous', 'B0670', 'B0946', 'Polyamide curing agent pound 651 pound(c)', 'C09084', 'AA-504/21114018', 'AE-848/02291057', 'Q411022', 'SR-01000712407', 'Q-100426', 'SR-01000712407-5', 'BRD-K68077509-001-01-6', 'Brucine, European Pharmacopoeia (EP) Reference Standard', 'BrucineBrucinum; 2,3-Dimethoxystrychnine; (-)-Brucine', '(1R,11S,18S,20R,21R,22S)-4,5-dimethoxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0^{1,18}.0^{2,7}.0^{8,22}.0^{11,21}.0^{15,20}]tetracosa-2,4,6,14-tetraen-9-one'] |
From Pubchem