CORTODOXONE 21-SULFATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H30O7S
Molecular Weight	426.524
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12CC[C@](O)(C(=O)COS(O)(=O)=O)[C@@]1(C)CC[C@@]3([H])[C@@]2([H])CCC4=CC(=O)CC[C@]34C

InChI

InChIKey=SHLYKOYOSFMUKN-OBQKJFGGSA-N

InChI=1S/C21H30O7S/c1-19-8-5-14(22)11-13(19)3-4-15-16(19)6-9-20(2)17(15)7-10-21(20,24)18(23)12-28-29(25,26)27/h11,15-17,24H,3-10,12H2,1-2H3,(H,25,26,27)/t15-,16+,17+,19+,20+,21+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C21H30O7S
Molecular Weight	426.524
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	6 / 6
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 16:24:11 GMT 2023` Edited by `admin` on `Fri Dec 15 16:24:11 GMT 2023`
Record UNII	33136109C2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CORTODOXONE 21-SULFATE

Common Name

English

CORTICOSTERONE, 11-DEOXY-17-HYDROXY-, 21-(HYDROGEN SULFATE)

Common Name

English

PREGN-4-ENE-3,20-DIONE, 17-HYDROXY-21-(SULFOOXY)-

Systematic Name

English

11-DEOXYCORTISOL SULFATE

Common Name

English

PREGN-4-ENE-3,20-DIONE, 17,21-DIHYDROXY-, 21-(HYDROGEN SULFATE)

Common Name

English

Code System Code Type Description

FDA UNII

33136109C2

Created by admin on Fri Dec 15 16:24:11 GMT 2023 , Edited by admin on Fri Dec 15 16:24:11 GMT 2023

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PUBCHEM

71586798

Created by admin on Fri Dec 15 16:24:11 GMT 2023 , Edited by admin on Fri Dec 15 16:24:11 GMT 2023

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EPA CompTox

DTXSID40189363

Created by admin on Fri Dec 15 16:24:11 GMT 2023 , Edited by admin on Fri Dec 15 16:24:11 GMT 2023

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CAS

3583-28-6

Created by admin on Fri Dec 15 16:24:11 GMT 2023 , Edited by admin on Fri Dec 15 16:24:11 GMT 2023

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