Buprenorphine Hydrochloride
(1S,2S,6R,14R,15R,16R)-5-(cyclopropylmethyl)-16-[(2S)-2-hydroxy-3,3-dimethylbutan-2-yl]-15-methoxy-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11-trien-11-ol;hydrochloride
Molecular Identity
Buprenorphine Hydrochloride
(1S,2S,6R,14R,15R,16R)-5-(cyclopropylmethyl)-16-[(2S)-2-hydroxy-3,3-dimethylbutan-2-yl]-15-methoxy-13-oxa-5-azahexacyclo[13.2.2.12,8.01,6.02,14.012,20]icosa-8(20),9,11-trien-11-ol;hydrochloride
PubChem CID: 3033050
2D Structure
Properties
C29H42ClNO4
Molecular Formula
504.10
Molecular Weight
g/mol
503.2802
Exact Mass
Da
62.2
TPSA
Good oral absorption (< 140 A²)
3
H-Bond Donors
5
H-Bond Acceptors
869
Complexity
SMILES
Canonical SMILES
SMILES: CC(C)(C)C(C)(C1CC23CCC1(C4C25CCN(C3CC6=C5C(=C(C=C6)O)O4)CC7CC7)OC)O.ClIsomeric SMILES
SMILES: C[C@]([C@H]1C[C@@]23CC[C@@]1([C@H]4[C@@]25CCN([C@@H]3CC6=C5C(=C(C=C6)O)O4)CC7CC7)OC)(C(C)(C)C)O.ClSynonyms(20)
BUPRENORPHINE HYDROCHLORIDE53152-21-9FinibronBelbucaBuprenorphine HclBuprexVetergesicAnorfinBupredermLepetanNopanUM 952ProbuphineRX 6029-M HCl56W8MW3EN1
Data from PubChem (NCBI)
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Trials and conditions connected to Buprenorphine Hydrochloride
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