ALLOPREGNANE-3.ALPHA.,11.BETA.,17.ALPHA.,21-TETROL-20-ONE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H34O5
Molecular Weight	366.4917
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ALLOPREGNANE-3.ALPHA.,11.BETA.,17.ALPHA.,21-TETROL-20-ONE

Structure Search

SMILES

[H][C@@]12CC[C@](O)(C(=O)CO)[C@@]1(C)C[C@H](O)[C@@]3([H])[C@@]2([H])CC[C@@]4([H])C[C@H](O)CC[C@]34C

InChI

InChIKey=AODPIQQILQLWGS-FDSHTENPSA-N

InChI=1S/C21H34O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-16,18,22-24,26H,3-11H2,1-2H3/t12-,13+,14-,15-,16-,18+,19-,20-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H34O5
Molecular Weight	366.4917
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Fri Dec 15 14:59:45 GMT 2023` Edited by `admin` on `Fri Dec 15 14:59:45 GMT 2023`
Record UNII	A30U7U312E
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ALLOPREGNANE-3.ALPHA.,11.BETA.,17.ALPHA.,21-TETROL-20-ONE

Common Name

English

17-(1-KETO-2-HYDROXYETHYL)ANDROSTANE-3,11,17-TRIOL

Systematic Name

English

REICHSTEIN'S SUBSTANCE C

Common Name

English

3.ALPHA.,11.BETA.,17,21-TETRAHYDROXY-5.ALPHA.-PREGNAN-20-ONE

Systematic Name

English

KENDALL'S COMPOUND C

Common Name

English

3.ALPHA.-ALLOTETRAHYDROCORTISOL

Common Name

English

WINTERSTEINER'S COMPOUND D

Common Name

English

3.ALPHA.,11.BETA.,17,21-TETRAHYDROXY-20-OXO-5.ALPHA.-PREGNANE

Systematic Name

English

ALLOTETRAHYDROCORTISOL

Common Name

English

3.ALPHA.,5.ALPHA.-TETRAHYDROCORTISOL

Common Name

English

NSC-86469

Code

English

(3.ALPHA.,5.ALPHA.,11.BETA.)-3,11,17,21-TETRAHYDROXYPREGNAN-20-ONE

Systematic Name

English

ALLOPREGNANE-3.ALPHA.,11.BETA.,17.ALPHA.,21-TETROL-20-ONE [MI]

Common Name

English

PREGNAN-20-ONE, 3,11,17,21-TETRAHYDROXY-, (3.ALPHA.,5.ALPHA.,11.BETA.)-

Systematic Name

English

Code System Code Type Description

FDA UNII

A30U7U312E