CAS RN 60491-10-3
IUPAC Navn:
bis((11S,18S,20R,21R,22S)-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one) sulfuric acid pentahydrate
Synonymer:
bis((11S,18S,20R,21R,22S)-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one) sulfuric acid pentahydrate
Molekylvægt (g/mol):
856.99
Molekylformel:
C42H56N4O13S
InChi Key:
FDQUTDUZMOOVST-YSVQHLMNSA-N
SMILES:
O.O.O.O.O.OS(O)(=O)=O.O=C1C[C@@H]2OCC=C3CN4CCC56[C@@H]4C[C@@H]3[C@@H]2[C@@H]5N1C1=CC=CC=C61.O=C1C[C@@H]2OCC=C3CN4CCC56[C@@H]4C[C@@H]3[C@@H]2[C@@H]5N1C1=CC=CC=C61
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Resultater
1
Strychnine Sulfate Hydrate, TRC
CAS: 60491-10-3 Molekylær formel: C42H44N4O4 • H2SO4 • 5H2O Molekylvægt (g/mol): 766.9 Synonym: Strychnidin-10-one, sulfate, hydrate,Strychnidin-10-one, sulfate, pentahydrate,Strychnine sulfate pentahydrate,Strychnine, sulfate, pentahydrate IUPAC navn: (4aR,5aS,8aR,13aS,15aS,15bR)-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;sulfuric acid;pentahydrate SMIL: C1CN2CC3=CCO[C@H]4CC(=O)N5[C@H]6[C@H]4[C@H]3C[C@H]2[C@@]61C7=CC=CC=C75.C1CN2CC3=CCO[C@H]4CC(=O)N5[C@H]6[C@H]4[C@H]3C[C@H]2[C@@]61C7=CC=CC=C75.O.O.O.O.O.OS(=O)(=O)O