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Details

Stereochemistry ABSOLUTE
Molecular Formula C42H58O10
Molecular Weight 722.9039
Optical Activity UNSPECIFIED
Defined Stereocenters 14 / 16
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Hydrocortisone dimer

SMILES

C[C@]12C[C@H](O)[C@H]3[C@@H](CCC4=CC(=O)CC[C@]34C)[C@@H]1CC[C@]2(O)C(=O)C(O)C(O)C(=O)[C@@]5(O)CC[C@H]6[C@@H]7CCC8=CC(=O)CC[C@]8(C)[C@H]7[C@@H](O)C[C@]56C

InChI

InChIKey=NLVJJNWVPIIREB-VBJPHBTASA-N
InChI=1S/C42H58O10/c1-37-13-9-23(43)17-21(37)5-7-25-27-11-15-41(51,39(27,3)19-29(45)31(25)37)35(49)33(47)34(48)36(50)42(52)16-12-28-26-8-6-22-18-24(44)10-14-38(22,2)32(26)30(46)20-40(28,42)4/h17-18,25-34,45-48,51-52H,5-16,19-20H2,1-4H3/t25-,26-,27-,28-,29-,30-,31+,32+,33?,34?,37-,38-,39-,40-,41-,42-/m0/s1

HIDE SMILES / InChI

Molecular Formula C42H58O10
Molecular Weight 722.9039
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 14 / 16
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:18:58 GMT 2025
Edited
by admin
on Mon Mar 31 23:18:58 GMT 2025
Record UNII
BY4US3P6VS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HYDROCORTISONE IMPURITY N [EP IMPURITY]
Preferred Name English
Hydrocortisone dimer
Common Name English
11?,17,21-Trihydroxy-21-(11?,17,21-trihydroxy-3,20-dioxopregn-4-en-21-yl)pregn-4-ene-3,20-dione
Systematic Name English
Code System Code Type Description
FDA UNII
BY4US3P6VS
Created by admin on Mon Mar 31 23:18:58 GMT 2025 , Edited by admin on Mon Mar 31 23:18:58 GMT 2025
PRIMARY
PUBCHEM
132990830
Created by admin on Mon Mar 31 23:18:58 GMT 2025 , Edited by admin on Mon Mar 31 23:18:58 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP