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17-(Cyclopropylmethyl)-7-(2-hydroxypropan-2-yl)-6-methoxy-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol--hydrogen chloride (1/1)

HCID 197949
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Basic information

CAS
16808-86-9
Standard SMILES
COC12CCC3(C[C@@H]1C(C)(C)O)[C@H]1Cc4ccc(O)c5c4[C@@]3(CCN1CC1CC1)[C@H]2O5.Cl
InChIKey
UNPUINKKJUSSDZ-NNGCTRGCSA-N
Molecular formula
C26H36ClNO4
Average molar mass
462 g/mol
Monoisotopic mass
461.2332863

Names & identifiers

Preferred name
17-(Cyclopropylmethyl)-7-(2-hydroxypropan-2-yl)-6-methoxy-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol--hydrogen chloride (1/1)
IUPAC
(2S,6R,14R,16R)-5-(cyclopropylmethyl)-16-(2-hydroxypropan-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
English name
6,14-Ethenomorphinan-7-methanol, 17-(cyclopropylmethyl)-4,5-epoxy-18,19-dihydro-3-hydroxy-6-methoxy-alpha, alpha-dimethyl-(5alpha, 7alpha) hydrochloride
Molecular formula
C26H36ClNO4
Molecular weight
462.03

Names & synonyms

DTXSID1093743417-(Cyclopropylmethyl)-7-(2-hydroxypropan-2-yl)-6-methoxy-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol--hydrogen chloride (1/1)17-(Cyclopropylmethyl)-7-(2-hydroxypropan-2-yl)-6-methoxy-5alpha,7alpha-18,19-dihydro-4,5-epoxy-6,14-ethenomorphinan-3-ol--hydrogen chloride (1/1)DPNClrevivonDPN HCLDIPRENORPHINE HYDROCHLORIDEDiprenorphine Hydrochloride (1.0 mg/ml in Methanol)hydrochloride,(5-alpha,7-alpha)-ha-dimethyl-5-epoxy-3-hydroxy-6-methoxy-6,14-endo-ethanetetrahydrooripavine,21-cyclopropyl-7-alpha-(1-hydroxy-1-meth6,14-ethenomorphinan-7-methanol,18,19-dihydro-17-(cyclopropylmethyl)-alpha,alp6,14-Ethenomorphinan-7-methanol, 17-(cyclopropylmethyl)-4,5-epoxy-18,19-dihydro-3-hydroxy-6-methoxy-a,a-dimethyl-, (5a, 7a), hydrochloride
Show more names
(5alpha,7alpha)-17-(cyclopropylmethyl)-4,5-epoxy-18,19-dihydro-3-hydroxy-6-methoxy-alpha,alpha-dimethyl-6,14-ethenomorphinan-7-methanol hydrochloride

Database identifiers

CAS
16808-86-9
PubChem CID
197949
DTXSID
DTXSID10937434

Properties

Computed structural properties

Topological polar surface area
62.2 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
32
Formal charge
0
Complexity
783

Physicochemical properties

solubility
soluble in Methanol
form
Solid
color
White
FDA UNII
7 IEP4SN · WBS7IEP4SN

Chemistry & industry

Applications

UsesClosely related to Cyprenorphine. Narcotic antagonist.

UsesDiprenorphine is a narcotic antagonist. Diprenorphine is closely related to Cyprenorphine.

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