Naloxone HCl Dihydrate
HIT106108040
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HIT ID: HIT106108040
Cas No: 51481-60-8
分子式: C19H26ClNO6
分子量: 399.87
常用名: Naloxone HCl Dihydrate
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 1.590000000000000e-001
IUPAC: (1S,5R,13R,17S)-10,17-dihydroxy-4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10-trien-14-one dihydrate hydrochloride
IUPAC: (1S,5R,13R,17S)-10,17-dihydroxy-4-(prop-2-en-1-yl)-12-oxa-4-azapentacyclo[9.6.1.0^{1,13}.0^{5,17}.0^{7,18}]octadeca-7(18),8,10-trien-14-one dihydrate hydrochloride
SMILES: O.O.Cl.Oc1ccc2C[C@H]3N(CC=C)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O |TLB:24:25:10.14.15:7.20.8,THB:26:25:10.14.15:7.20.8|
SMILES: O.O.Cl.Oc1ccc2C[C@H]3N(CC=C)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O |TLB:24:25:10.14.15:7.20.8,THB:26:25:10.14.15:7.20.8|
InChI key: TXMZWEASFRBVKY-IOQDSZRYSA-N
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