HIT ID: HIT218701087

Cas No:

分子式: C22H24N2O8

分子量: 450.477

常用名: (4S,4aS,5aS,6S,12aS)-4-[di(2H3)methylamino]-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide, Tetracycline-d6

氢键受体数 (HBA):

氢键供体数 (HBD):

LogP:

IUPAC: (4S,4aS,5aS,6S,12aS)-4-[di(2H3)methylamino]-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide

SMILES: [H][C@@]12C[C@@]3([H])C(C(=O)c4c(O)cccc4[C@@]3(C)O)=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@H]2N(C([2H])([2H])[2H])C([2H])([2H])[2H]

InChI key: OFVLGDICTFRJMM-CJQNGSMCSA-N