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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H35NO5.ClH
Molecular Weight 490.031
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACETORPHINE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12OC3=C(OC(C)=O)C=CC4=C3[C@@]15CCN(C)[C@]([H])(C4)[C@@]56C[C@]([H])([C@](C)(O)CCC)[C@]2(OC)C=C6

InChI

InChIKey=NDKZQFXDYCJPKG-PXCSINNHSA-N
InChI=1S/C27H35NO5.ClH/c1-6-9-24(3,30)19-15-25-10-11-27(19,31-5)23-26(25)12-13-28(4)20(25)14-17-7-8-18(32-16(2)29)22(33-23)21(17)26;/h7-8,10-11,19-20,23,30H,6,9,12-15H2,1-5H3;1H/t19-,20-,23-,24-,25-,26+,27-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C27H35NO5
Molecular Weight 453.5705
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 7 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:31:12 UTC 2023
Edited
by admin
on Sat Dec 16 01:31:12 UTC 2023
Record UNII
60E212GZCG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACETORPHINE HYDROCHLORIDE
Common Name English
19-PROPYLORVINOL, 3-ACETATE HYDROCHLORIDE
Common Name English
ETORPHINE 3-ACETATE HYDROCHLORIDE [MI]
Common Name English
(.ALPHA.R,5.ALPHA.,7.ALPHA.)-4,5-EPOXY-3-HYDROXY-6-METHOXY-.ALPHA.,17-DIMETHYL-.ALPHA.-PROPYL-6,14-ETHENOMORPHINAN-7-METHANOL
Common Name English
M-183
Code English
ETORPHINE 3-ACETATE HYDROCHLORIDE
MI  
Common Name English
Code System Code Type Description
MERCK INDEX
m5201
Created by admin on Sat Dec 16 01:31:12 UTC 2023 , Edited by admin on Sat Dec 16 01:31:12 UTC 2023
PRIMARY Merck Index
CAS
25333-78-2
Created by admin on Sat Dec 16 01:31:12 UTC 2023 , Edited by admin on Sat Dec 16 01:31:12 UTC 2023
PRIMARY
PUBCHEM
71587068
Created by admin on Sat Dec 16 01:31:12 UTC 2023 , Edited by admin on Sat Dec 16 01:31:12 UTC 2023
PRIMARY
FDA UNII
60E212GZCG
Created by admin on Sat Dec 16 01:31:12 UTC 2023 , Edited by admin on Sat Dec 16 01:31:12 UTC 2023
PRIMARY
EPA CompTox
DTXSID70179979
Created by admin on Sat Dec 16 01:31:12 UTC 2023 , Edited by admin on Sat Dec 16 01:31:12 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE