DEXAMETHASONE METASULFOBENZOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C29H33FO9S
Molecular Weight	576.63
Optical Activity	UNSPECIFIED
Defined Stereocenters	8 / 8
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DEXAMETHASONE METASULFOBENZOATE

Structure Search

SMILES

[H][C@@]12C[C@@H](C)[C@](O)(C(=O)COC(=O)C3=CC(=CC=C3)S(O)(=O)=O)[C@@]1(C)C[C@H](O)[C@@]4(F)[C@@]2([H])CCC5=CC(=O)C=C[C@]45C

InChI

InChIKey=TWQWRHIQRAZHPR-XNXCGYEVSA-N

InChI=1S/C29H33FO9S/c1-16-11-22-21-8-7-18-13-19(31)9-10-26(18,2)28(21,30)23(32)14-27(22,3)29(16,35)24(33)15-39-25(34)17-5-4-6-20(12-17)40(36,37)38/h4-6,9-10,12-13,16,21-23,32,35H,7-8,11,14-15H2,1-3H3,(H,36,37,38)/t16-,21+,22+,23+,26+,27+,28+,29+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C29H33FO9S
Molecular Weight	576.63
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 `Fri Dec 15 19:38:28 UTC 2023` Edited by `admin` on `Fri Dec 15 19:38:28 UTC 2023`
Record UNII	C67221CB9Q
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

DEXAMETHASONE METASULFOBENZOATE

Common Name

English

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

Common Name

English

DEXAMETHASONE M-SULFOBENZOATE

Common Name

English

Code System Code Type Description

FDA UNII

C67221CB9Q