22-NBD Cholesterol
HIT218832868
sdf文件结构编辑类似物检索
HIT ID: HIT218832868
Cas No:
分子式: C28H38N4O4
分子量: 494.636
常用名: 22-NBD Cholesterol
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: 9a,11a-dimethyl-1-{1-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]propan-2-yl}-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
IUPAC: 9a,11a-dimethyl-1-{1-[(7-nitro-2,1,3-benzoxadiazol-4-yl)amino]propan-2-yl}-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
SMILES: CC(CNc1ccc([N+]([O-])=O)c2nonc12)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
SMILES: CC(CNc1ccc([N+]([O-])=O)c2nonc12)C1CCC2C3CC=C4CC(O)CCC4(C)C3CCC12C
InChI key: DLWLXTLRGQWGPC-UHFFFAOYSA-N
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