Name: 3β-[N-(N′,N′-Dimethylaminoethyl)carbamoyl]cholesterol
Rating: 5 (10 reviews)

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HIT ID:HIT212720444
Cas No:137056-72-5
常用名:3β-[N-(N′,N′-Dimethylaminoethyl)carbamoyl]cholesterol
常用名:3β-[N-(N′,N′-Dimethylaminoethyl)carbamoyl]cholesterol
别名:DC-Chol, 3β-[N-(N′,N′-Dimethylaminoethyl)carbamoyl]cholesterol
别名:DC-Chol, 3β-[N-(N′,N′-Dimethylaminoethyl)carbamoyl]cholesterol
IUPAC:(1R,3aS,3bS,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl N-[2-(dimethylamino)ethyl]carbamate
IUPAC:(1R,3aS,3bS,7S,9aR,9bS,11aR)-9a,11a-dimethyl-1-[(2R)-6-methylheptan-2-yl]-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-yl N-[2-(dimethylamino)ethyl]carbamate
InChI key:HIHOWBSBBDRPDW-PTHRTHQKSA-N

分子式:C32H56N2O2
分子量:500.812
氢键供体数 (HBD):1
氢键受体数 (HBA):2
LogP:7.4627895
SMILES:CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)NCCN(C)C |t:14|
SMILES:CC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@H](CC[C@]4(C)[C@H]3CC[C@]12C)OC(=O)NCCN(C)C |t:14|

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