ISOFLUPREDONE 21-PHOSPHATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H28FO8P
Molecular Weight	458.4144
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=UWJRRPBVAKDVFZ-BULBTXNYSA-N

InChI=1S/C21H28FO8P/c1-18-7-5-13(23)9-12(18)3-4-15-14-6-8-20(26,17(25)11-30-31(27,28)29)19(14,2)10-16(24)21(15,18)22/h5,7,9,14-16,24,26H,3-4,6,8,10-11H2,1-2H3,(H2,27,28,29)/t14-,15-,16-,18-,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H28FO8P
Molecular Weight	458.4144
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	7 / 7
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:33:17 GMT 2025` Edited by `admin` on `Mon Mar 31 21:33:17 GMT 2025`
Record UNII	L435KAN4YG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ISOFLUPREDONE 21-PHOSPHATE

Common Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11.BETA.,17,21-TRIHYDROXY-, 21-(DIHYDROGEN PHOSPHATE)

Preferred Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11,17-DIHYDROXY-21-(PHOSPHONOOXY)-, (11.BETA.)-

Systematic Name

English

PREGNA-1,4-DIENE-3,20-DIONE, 9-FLUORO-11.BETA.,17,21-TRIHYDROXY-, 21-PHOSPHATE

Systematic Name

English

Code System Code Type Description

CAS

432-44-0

Created by admin on Mon Mar 31 21:33:17 GMT 2025 , Edited by admin on Mon Mar 31 21:33:17 GMT 2025

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PUBCHEM

71586759

Created by admin on Mon Mar 31 21:33:17 GMT 2025 , Edited by admin on Mon Mar 31 21:33:17 GMT 2025

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EPA CompTox

DTXSID40195782

Created by admin on Mon Mar 31 21:33:17 GMT 2025 , Edited by admin on Mon Mar 31 21:33:17 GMT 2025

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FDA UNII

L435KAN4YG

Created by admin on Mon Mar 31 21:33:17 GMT 2025 , Edited by admin on Mon Mar 31 21:33:17 GMT 2025

PRIMARY