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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H36FNO7.ClH
Molecular Weight 542.037
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 21-(.BETA.-ALANYL)TRIAMCINOLONE ACETONIDE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12C[C@@]3([H])[C@]4([H])CCC5=CC(=O)C=C[C@]5(C)[C@@]4(F)[C@@H](O)C[C@]3(C)[C@@]1(OC(C)(C)O2)C(=O)COC(=O)CCN

InChI

InChIKey=MACYUUJZMWQRKL-FMDRZALXSA-N
InChI=1S/C27H36FNO7.ClH/c1-23(2)35-21-12-18-17-6-5-15-11-16(30)7-9-24(15,3)26(17,28)19(31)13-25(18,4)27(21,36-23)20(32)14-34-22(33)8-10-29;/h7,9,11,17-19,21,31H,5-6,8,10,12-14,29H2,1-4H3;1H/t17-,18-,19-,21+,24-,25-,26-,27+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C27H36FNO7
Molecular Weight 505.5756
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
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

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 14:55:45 GMT 2023
Edited
by admin
on Sat Dec 16 14:55:45 GMT 2023
Record UNII
KEZ815U79L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
21-(.BETA.-ALANYL)TRIAMCINOLONE ACETONIDE HYDROCHLORIDE
Systematic Name English
21-.BETA.-ALANYL TRIAMCINOLONE ACETONIDE HYDROCHLORIDE
Systematic Name English
Code System Code Type Description
FDA UNII
KEZ815U79L
Created by admin on Sat Dec 16 14:55:45 GMT 2023 , Edited by admin on Sat Dec 16 14:55:45 GMT 2023
PRIMARY
PUBCHEM
137331853
Created by admin on Sat Dec 16 14:55:45 GMT 2023 , Edited by admin on Sat Dec 16 14:55:45 GMT 2023
PRIMARY
CAS
1961317-03-2
Created by admin on Sat Dec 16 14:55:45 GMT 2023 , Edited by admin on Sat Dec 16 14:55:45 GMT 2023
PRIMARY
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