Samidorphan-d5
HIT218849479
sdf文件结构编辑类似物检索
HIT ID: HIT218849479
Cas No:
分子式: C21H26N2O4
分子量: 375.48
常用名: Samidorphan-d5
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1R,9R,10S)-17-(cyclopropylmethyl)-3,10-dihydroxy-13-oxo(6,12,12,14,14-2H5)-17-azatetracyclo[7.5.3.0^{1,10}.0^{2,7}]heptadeca-2,4,6-triene-4-carboxamide
IUPAC: (1R,9R,10S)-17-(cyclopropylmethyl)-3,10-dihydroxy-13-oxo(6,12,12,14,14-2H5)-17-azatetracyclo[7.5.3.0^{1,10}.0^{2,7}]heptadeca-2,4,6-triene-4-carboxamide
SMILES: [2H]c1cc(C(N)=O)c(O)c2c1C[C@H]1N(CC3CC3)CC[C@@]22C([2H])([2H])C(=O)C([2H])([2H])C[C@@]12O
SMILES: [2H]c1cc(C(N)=O)c(O)c2c1C[C@H]1N(CC3CC3)CC[C@@]22C([2H])([2H])C(=O)C([2H])([2H])C[C@@]12O
InChI key: RYIDHLJADOKWFM-YMAJZTJVSA-N
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