DEXAMETHASONE 17,21-METHYLORTHOVALERATE

Details

Stereochemistry	EPIMERIC
Molecular Formula	C28H39FO6
Molecular Weight	490.6041
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DEXAMETHASONE 17,21-METHYLORTHOVALERATE

Structure Search

SMILES

[H][C@@]12C[C@@H](C)[C@@]3(OC(CCCC)(OC)OCC3=O)[C@@]1(C)C[C@H](O)[C@@]4(F)[C@@]2([H])CCC5=CC(=O)C=C[C@]45C

InChI

InChIKey=BDIYOTVTJVHFJF-TTZIFLTOSA-N

InChI=1S/C28H39FO6/c1-6-7-11-26(33-5)34-16-23(32)28(35-26)17(2)13-21-20-9-8-18-14-19(30)10-12-24(18,3)27(20,29)22(31)15-25(21,28)4/h10,12,14,17,20-22,31H,6-9,11,13,15-16H2,1-5H3/t17-,20+,21+,22+,24+,25+,26?,27+,28+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C28H39FO6
Molecular Weight	490.6041
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	8 / 9
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 15:14:24 UTC 2023` Edited by `admin` on `Fri Dec 15 15:14:24 UTC 2023`
Record UNII	5II1GNB52R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DEXAMETHASONE 17,21-METHYLORTHOVALERATE

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11-HYDROXY-17,21-((1-METHOXYPENTYLIDENE)BIS(OXY))-16-METHYL-, (11.BETA.,16.ALPHA.)-

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11.BETA.,17,21-TRIHYDROXY-16.ALPHA.-METHYL-, CYCLIC 17,21-(METHYL ORTHOVALERATE)

Common Name

English

Code System Code Type Description

FDA UNII

5II1GNB52R