U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H39NO6.ClH
Molecular Weight 510.063
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PREDNISOLAMATE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12CC[C@](O)(C(=O)COC(=O)CN(CC)CC)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])CCC4=CC(=O)C=C[C@]34C

InChI

InChIKey=LVBOKCPYKGRUCG-OYHXESGYSA-N
InChI=1S/C27H39NO6.ClH/c1-5-28(6-2)15-23(32)34-16-22(31)27(33)12-10-20-19-8-7-17-13-18(29)9-11-25(17,3)24(19)21(30)14-26(20,27)4;/h9,11,13,19-21,24,30,33H,5-8,10,12,14-16H2,1-4H3;1H/t19-,20-,21-,24+,25-,26-,27-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C27H39NO6
Molecular Weight 473.6017
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

PREDNISOLAMATE is a synthetic corticosteroid.

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 18:06:35 GMT 2023
Edited
by admin
on Fri Dec 15 18:06:35 GMT 2023
Record UNII
KK81V776LD
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PREDNISOLAMATE HYDROCHLORIDE
MART.   WHO-DD  
Common Name English
Prednisolamate hydrochloride [WHO-DD]
Common Name English
11.BETA.,17.ALPHA.,21-TRIHYDROXYPREGNA-1,4-DIENE-3,20-DIONE 21-DIETHYLAMINOACETATE HYDROCHLORIDE
Common Name English
PREDNISOLAMATE HYDROCHLORIDE [MART.]
Common Name English
GLYCINE, N,N-DIETHYL-, (11.BETA.)-11,17-DIHYDROXY-3,20-DIOXOPREGNA-1,4-DIEN-21-YL ESTER, HYDROCHLORIDE (1:1)
Common Name English
NSC-12883
Code English
PREDNISOLONE 21-DIETHYLAMINOACETATE HYDROCHLORIDE [MI]
Common Name English
PREDNISOLONE 21-DIETHYLAMINOACETATE HYDROCHLORIDE
MI  
Common Name English
Code System Code Type Description
SMS_ID
100000087591
Created by admin on Fri Dec 15 18:06:35 GMT 2023 , Edited by admin on Fri Dec 15 18:06:35 GMT 2023
PRIMARY
EVMPD
SUB20371
Created by admin on Fri Dec 15 18:06:35 GMT 2023 , Edited by admin on Fri Dec 15 18:06:35 GMT 2023
PRIMARY
MERCK INDEX
m902
Created by admin on Fri Dec 15 18:06:35 GMT 2023 , Edited by admin on Fri Dec 15 18:06:35 GMT 2023
PRIMARY Merck Index
CAS
17140-01-1
Created by admin on Fri Dec 15 18:06:35 GMT 2023 , Edited by admin on Fri Dec 15 18:06:35 GMT 2023
PRIMARY
EPA CompTox
DTXSID60169081
Created by admin on Fri Dec 15 18:06:35 GMT 2023 , Edited by admin on Fri Dec 15 18:06:35 GMT 2023
PRIMARY
FDA UNII
KK81V776LD
Created by admin on Fri Dec 15 18:06:35 GMT 2023 , Edited by admin on Fri Dec 15 18:06:35 GMT 2023
PRIMARY
PUBCHEM
24181947
Created by admin on Fri Dec 15 18:06:35 GMT 2023 , Edited by admin on Fri Dec 15 18:06:35 GMT 2023
PRIMARY
NSC
12883
Created by admin on Fri Dec 15 18:06:35 GMT 2023 , Edited by admin on Fri Dec 15 18:06:35 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY