68-20-2 ((2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-N-(hydroxymethyl)-6-methyl-1,11-dioxo-, monosodium salt, [4S-(4α,4aα,5aα,6β,12aα)]- (9CI))

CAS号:
68-20-2
英文名称:
2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-N-(hydroxymethyl)-6-methyl-1,11-dioxo-, monosodium salt, [4S-(4α,4aα,5aα,6β,12aα)]- (9CI)
分子式:
C23H26ClN2NaO9
分子量:
532.90331697464

2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-N-(hydroxymethyl)-6-methyl-1,11-dioxo-, monosodium salt, [4S-(4α,4aα,5aα,6β,12aα)]- (9CI)(68-20-2)名称与标识符

名称

英文别名:
sodium,(1S,4aS,11S,11aS,12aS)-10-chloro-1-(dimethylamino)-4a,6,7,11-tetrahydroxy-3-(hydroxymethylcarbamoyl)-11-methyl-4,5-dioxo-1,11a,12,12a-tetrahydrotetracen-2-olate;2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-N-(hydroxymethyl)-6-methyl-1,11-dioxo-, monosodium salt, [4S-(4α,4aα,5aα,6β,12aα)]- (9CI);

标识符

InChIKey:
LSVVTQJQOCFIEK-FOUULCKCSA-N
Inchi:
1S/C23H25ClN2O9.Na.H/c1-22(34)8-6-9-16(26(2)3)18(30)14(21(33)25-7-27)20(32)23(9,35)19(31)12(8)17(29)13-11(28)5-4-10(24)15(13)22;;/h4-5,8-9,16,27-28,30-31,34-35H,6-7H2,1-3H3,(H,25,33);;/t8-,9-,16-,22-,23-;;/m0../s1
SMILES:
O[C@@]12C(C(C(=O)NCO)=C(O)[C@@H](N(C)C)[C@]1([H])C[C@]1([H])[C@@](C3C(=CC=C(O)C=3C(=O)C1=C2O)Cl)(O)C)=O.[NaH]

2-Naphthacenecarboxamide, 7-chloro-4-(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-N-(hydroxymethyl)-6-methyl-1,11-dioxo-, monosodium salt, [4S-(4α,4aα,5aα,6β,12aα)]- (9CI)(68-20-2)相关文献