| 2D Structure | |
| CID | 6000 |
| IUPAC Name | (1S,16R)-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21-diol |
| InChI | InChI=1S/C37H40N2O6/c1-38-14-12-24-19-32(42-4)33-21-27(24)28(38)16-22-6-9-26(10-7-22)44-37-35-25(20-34(43-5)36(37)41)13-15-39(2,3)29(35)17-23-8-11-30(40)31(18-23)45-33/h6-11,18-21,28-29H,12-17H2,1-5H3,(H-,40,41)/p+1/t28-,29+/m0/s1 |
| InChI Key | JFJZZMVDLULRGK-URLMMPGGSA-O |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C37H41N2O6+ |
| Molecular Weight | 609.7 |
| synonyms | ['tubocurarine', 'd-Tubocurarine', 'Tubocurarin', '(+)-Tubocurarine', 'Tubocurarinum', '57-95-4', 'Tubocurarine ion', 'Tubocurarine cation', 'W9YXS298BM', 'CHEBI:9774', "7',12'-Dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyltubocuraranium", 'DTXSID0048393', "Tubocuraranium, 7',12'-dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyl-", "13H-4,6:21,24-Dietheno-8,12-metheno-1H-pyrido(3',2':14,15)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinolinium, 2,3,13a,14,15,16,25,25a-octahydro-9,19-dihydroxy-18,29-dimethoxy-1,14,14-trimethyl-, (13aR,25aS)-", '(1S,16R)-9,21-dihydroxy-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-15,30-diazaheptacyclo(22.6.2.2^(3,6).1^(8,12).1^(18,22).0^(27,31).0^(16,34))hexatriaconta-3,5,8,10,12(34),18(33),19,21,24(32),25,27(31),35-dodecaen-15-ium', '(1S,16R)-9,21-dihydroxy-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-15,30-diazaheptacyclo[22.6.2.2^{3,6}.1^{8,12}.1^{18,22}.0^{27,31}.0^{16,34}]hexatriaconta-3,5,8,10,12(34),18(33),19,21,24(32),25,27(31),35-dodecaen-15-ium', 'RefChem:56473', 'DTXCID1028366', '(1S,16R)-9,21-dihydroxy-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-15,30-diazaheptacyclo(22.6.2.23,6.18,12.118,22.027,31.016,34)hexatriaconta-3,5,8(34),9,11,18(33),19,21,24,26,31,35-dodecaen-15-ium', 'Delacurarine', 'Isoquinoline alkaloid', '(+)-Tubocurarine chloride', "7',12'-dihydroxy-6,6'-dimethoxy-2,2',2'-trimethyltubocuraran-2'-ium", '(+) Tubocurarine', '(1S,16R)-10,25-dimethoxy-15,15,30-trimethyl-7,23-dioxa-30-aza-15-azoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaene-9,21-diol', 'NCGC00163242-01', 'UNII-W9YXS298BM', 'HSDB 2152', 'TC9', 'Tubocurarine, (+)-', 'Spectrum_001966', 'SpecPlus_000475', 'Spectrum2_001335', 'Spectrum3_001095', 'Spectrum4_001922', 'Spectrum5_000685', 'Epitope ID:174836', 'TUBOCURARINE [HSDB]', 'dimethoxy(trimethyl)[?]diol', 'TUBOCURARINE [VANDF]', 'BSPBio_002770', 'KBioGR_002264', 'KBioSS_002526', 'MLS003882581', 'DivK1c_006571', 'SCHEMBL121375', 'TUBOCURARINE [WHO-DD]', 'SPBio_001489', 'CHEMBL339427', 'GTPL2294', 'SCHEMBL29383456', 'SCHEMBL30338684', 'KBio1_001515', 'KBio2_002518', 'KBio2_005086', 'KBio2_007654', 'KBio3_001990', 'JFJZZMVDLULRGK-URLMMPGGSA-O', 'HMS2089C06', 'BDBM50366799', 'PDSP1_001485', 'PDSP2_001469', 'DB01199', 'SDCCGMLS-0066631.P001', 'NCGC00163242-02', 'NCGC00178480-01', "13H-4,6:21,24-Dietheno-8,12-metheno-1H-pyrido(3',2':14,15)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinolinium, 2,3,13a,14,15,16,25,25a-octahydro-9,19-dihydroxy-18,29-dimethoxy-1,14,14-trimethyl-, (13aR-(13aR*,25aS*))-", 'SMR002533646', 'SBI-0052455.P002', 'NS00006658', 'C07547', 'AB00053831-03', 'AB00053831_04', 'Q421268', 'SR-05000001878-4', 'BRD-K99621550-003-03-4', 'BRD-K99621550-300-01-8', "13H-4,6:21,24-Dietheno-8,12-metheno-1H-pyrido[3',2':14,15][1,11]dioxacycloeicosino[2,3,4-ij]isoquinolinium,2,3,13a,14,15,16,25,25a-octahydro-9,19-dihydroxy-18,29-dimethoxy-1,14,14-trimethyl-,(13ar,25a"] |
From Pubchem