21-HYDROXY-17-((1-OXOPENTYL)OXY)PREGN-4-ENE-3,20-DIONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C26H38O5
Molecular Weight	430.5769
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 21-HYDROXY-17-((1-OXOPENTYL)OXY)PREGN-4-ENE-3,20-DIONE

Structure Search

SMILES

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

InChI

InChIKey=ASPFAYCVAKUOPF-MTVQHZRTSA-N

InChI=1S/C26H38O5/c1-4-5-6-23(30)31-26(22(29)16-27)14-11-21-19-8-7-17-15-18(28)9-12-24(17,2)20(19)10-13-25(21,26)3/h15,19-21,27H,4-14,16H2,1-3H3/t19-,20+,21+,24+,25+,26+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C26H38O5
Molecular Weight	430.5769
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 `Sat Dec 16 14:28:49 GMT 2023` Edited by `admin` on `Sat Dec 16 14:28:49 GMT 2023`
Record UNII	PFY8NSU2CX
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

21-HYDROXY-17-((1-OXOPENTYL)OXY)PREGN-4-ENE-3,20-DIONE

Systematic Name

English

PREGN-4-ENE-3,20-DIONE, 21-HYDROXY-17-((1-OXOPENTYL)OXY)-

Systematic Name

English

PREGN-4-ENE-3,20-DIONE, 17,21-DIHYDROXY-, 17-VALERATE

Common Name

English

Code System Code Type Description

CAS

102216-85-3

Created by admin on Sat Dec 16 14:28:49 GMT 2023 , Edited by admin on Sat Dec 16 14:28:49 GMT 2023

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PUBCHEM

101098564

Created by admin on Sat Dec 16 14:28:49 GMT 2023 , Edited by admin on Sat Dec 16 14:28:49 GMT 2023

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FDA UNII

PFY8NSU2CX

Created by admin on Sat Dec 16 14:28:49 GMT 2023 , Edited by admin on Sat Dec 16 14:28:49 GMT 2023

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Related Record Type Details


					PFY8NSU2CX

21-HYDROXY-17-((1-OXOPENTYL)OXY)PREGN-4-ENE-3,20-DIONE

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