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Details

Stereochemistry ABSOLUTE
Molecular Formula C29H31NO4
Molecular Weight 457.5607
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-[(5?,7?)-4,5-Epoxy-6-methoxy-17-methyl-3-(phenylmethoxy)-6,14-ethenomorphinan-7-yl]ethanone

SMILES

CO[C@]12C=C[C@@]3(C[C@@H]1C(C)=O)[C@H]4CC5=C6C(O[C@@H]2[C@@]36CCN4C)=C(OCC7=CC=CC=C7)C=C5

InChI

InChIKey=YUAMOTVQCHPCBV-ZYGOFEOWSA-N
InChI=1S/C29H31NO4/c1-18(31)21-16-27-11-12-29(21,32-3)26-28(27)13-14-30(2)23(27)15-20-9-10-22(25(34-26)24(20)28)33-17-19-7-5-4-6-8-19/h4-12,21,23,26H,13-17H2,1-3H3/t21-,23-,26-,27-,28+,29-/m1/s1

HIDE SMILES / InChI

Molecular Formula C29H31NO4
Molecular Weight 457.5607
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 6
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:25:56 GMT 2025
Edited
by admin
on Wed Apr 02 21:25:56 GMT 2025
Record UNII
4ZC7K35GGA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Ethanone, 1-[(5?,7?)-4,5-epoxy-6-methoxy-17-methyl-3-(phenylmethoxy)-6,14-ethenomorphinan-7-yl]-
Preferred Name English
1-[(5?,7?)-4,5-Epoxy-6-methoxy-17-methyl-3-(phenylmethoxy)-6,14-ethenomorphinan-7-yl]ethanone
Systematic Name English
Code System Code Type Description
CAS
1020267-11-1
Created by admin on Wed Apr 02 21:25:56 GMT 2025 , Edited by admin on Wed Apr 02 21:25:56 GMT 2025
PRIMARY
FDA UNII
4ZC7K35GGA
Created by admin on Wed Apr 02 21:25:56 GMT 2025 , Edited by admin on Wed Apr 02 21:25:56 GMT 2025
PRIMARY