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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H33NO7
Molecular Weight 483.5534
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5?H-Pregna-1,4-dieno[17,16-d]oxazole-3,20-dione, 11,21-bis(acetyloxy)-2?-methyl-, (11?,16?)-

SMILES

CC(=O)OCC(=O)[C@@]12N=C(C)O[C@@H]1C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@H](C[C@]23C)OC(C)=O

InChI

InChIKey=FQQKLFSLSCOADB-NBZCPFCYSA-N
InChI=1S/C27H33NO7/c1-14-28-27(22(32)13-33-15(2)29)23(34-14)11-20-19-7-6-17-10-18(31)8-9-25(17,4)24(19)21(35-16(3)30)12-26(20,27)5/h8-10,19-21,23-24H,6-7,11-13H2,1-5H3/t19-,20-,21-,23+,24+,25-,26-,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H33NO7
Molecular Weight 483.5534
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 15:24:07 GMT 2025
Edited
by admin
on Wed Apr 02 15:24:07 GMT 2025
Record UNII
LK3AP6Q5PX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
[2-[(1S,2S,4R,8S,9S,11S,12S,13R)-11-acetyloxy-6,9,13-trimethyl-16-oxo-5-oxa-7-azapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,14,17-trien-8-yl]-2-oxoethyl] acetate
Preferred Name English
5?H-Pregna-1,4-dieno[17,16-d]oxazole-3,20-dione, 11,21-bis(acetyloxy)-2?-methyl-, (11?,16?)-
Common Name English
Code System Code Type Description
PUBCHEM
169434517
Created by admin on Wed Apr 02 15:24:07 GMT 2025 , Edited by admin on Wed Apr 02 15:24:07 GMT 2025
PRIMARY
FDA UNII
LK3AP6Q5PX
Created by admin on Wed Apr 02 15:24:07 GMT 2025 , Edited by admin on Wed Apr 02 15:24:07 GMT 2025
PRIMARY
CAS
710951-92-1
Created by admin on Wed Apr 02 15:24:07 GMT 2025 , Edited by admin on Wed Apr 02 15:24:07 GMT 2025
PRIMARY