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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H23NO4
Molecular Weight 329.3902
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-NALOXOL

SMILES

[H][C@@]12OC3=C4C(C[C@H]5N(CC=C)CC[C@@]14[C@@]5(O)CC[C@H]2O)=CC=C3O

InChI

InChIKey=HMWHERQFMBEHNG-CSJNCLCHSA-N
InChI=1S/C19H23NO4/c1-2-8-20-9-7-18-15-11-3-4-12(21)16(15)24-17(18)13(22)5-6-19(18,23)14(20)10-11/h2-4,13-14,17,21-23H,1,5-10H2/t13-,14-,17+,18+,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H23NO4
Molecular Weight 329.3902
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 5 / 5
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:41:24 GMT 2023
Edited
by admin
on Sat Dec 16 13:41:24 GMT 2023
Record UNII
QY92ZV4EHS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.BETA.-NALOXOL
Common Name English
MORPHINAN-3,6,14-TRIOL, 4,5-EPOXY-17-(2-PROPENYL)-, (5.ALPHA.,6.BETA.)-
Common Name English
.BETA.-NALOXOL [MI]
Common Name English
6.BETA.-NALOXOL
Common Name English
(5.ALPHA.,6.BETA.)-4,5-EPOXY-17-(2-PROPEN-1-YL)MORPHINAN-3,6,14-TRIOL
Common Name English
N-ALLYL-14-HYDROXY-7,8-DIHYDRONORISOMORPHINE
Systematic Name English
MORPHINAN-3,6,14-TRIOL, 4,5-EPOXY-17-(2-PROPEN-1-YL)-, (5.ALPHA.,6.BETA.)-
Common Name English
Code System Code Type Description
FDA UNII
QY92ZV4EHS
Created by admin on Sat Dec 16 13:41:24 GMT 2023 , Edited by admin on Sat Dec 16 13:41:24 GMT 2023
PRIMARY
PUBCHEM
11002006
Created by admin on Sat Dec 16 13:41:24 GMT 2023 , Edited by admin on Sat Dec 16 13:41:24 GMT 2023
PRIMARY
MERCK INDEX
m11769
Created by admin on Sat Dec 16 13:41:24 GMT 2023 , Edited by admin on Sat Dec 16 13:41:24 GMT 2023
PRIMARY
SMS_ID
300000013067
Created by admin on Sat Dec 16 13:41:24 GMT 2023 , Edited by admin on Sat Dec 16 13:41:24 GMT 2023
PRIMARY
EPA CompTox
DTXSID80201230
Created by admin on Sat Dec 16 13:41:24 GMT 2023 , Edited by admin on Sat Dec 16 13:41:24 GMT 2023
PRIMARY
CAS
53154-12-4
Created by admin on Sat Dec 16 13:41:24 GMT 2023 , Edited by admin on Sat Dec 16 13:41:24 GMT 2023
PRIMARY