PREGNANDIOL

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National Institutes of Health Divider Arrow

NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C21H36O2
Molecular Weight	320.5093
Optical Activity	UNSPECIFIED
Defined Stereocenters	9 / 9
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of PREGNANDIOL

Structure Search

SMILES

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

InChI

InChIKey=YWYQTGBBEZQBGO-BERLURQNSA-N

InChI=1S/C21H36O2/c1-13(22)17-6-7-18-16-5-4-14-12-15(23)8-10-20(14,2)19(16)9-11-21(17,18)3/h13-19,22-23H,4-12H2,1-3H3/t13-,14+,15+,16-,17+,18-,19-,20-,21+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C21H36O2
Molecular Weight	320.5093
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 16:17:45 UTC 2023` Edited by `admin` on `Fri Dec 15 16:17:45 UTC 2023`
Record UNII	JR3JD1Y22C
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

PREGNANDIOL

Systematic Name

English

NSC-47462

Code

English

PREGNANEDIOL

Systematic Name

English

DIOL

Brand Name

English

PREGNANEDIOL [MI]

Common Name

English

5.BETA.-PREGNANE-3.ALPHA.,20.ALPHA.-DIOL

Common Name

English

(3.ALPHA.,5.BETA.,20.ALPHA.)-PREGNANE-3,20-DIOL

Common Name

English

PREGNANE-3,20-DIOL, (3.ALPHA.,5.BETA.,20S)-

Systematic Name

English

3.ALPHA.,20.ALPHA.-DIHYDROXY-5.BETA.-PREGNANE

Common Name

English

Pregnandiol [WHO-DD]

Common Name

English

NSC-1612

Code

English

PREGNANDIOL [JAN]

Common Name

English

Classification Tree Code System Code

LOINC

34358-2

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

LOINC

14885-8

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

LOINC

82895-4

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

LOINC

2832-4

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

LOINC

2834-0

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

LOINC

15091-2

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

LOINC

34359-0

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

LOINC

2833-2

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

CFR

21 CFR 862.1605

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

CFR

21 CFR 862.1430

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

LOINC

82894-7

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

NCI_THESAURUS

C776

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

Code System Code Type Description

EPA CompTox

DTXSID6046218

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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NSC

47462

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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WIKIPEDIA

PREGNANEDIOL

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

PRIMARY

FDA UNII

JR3JD1Y22C

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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NCI_THESAURUS

C82314

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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NSC

1612

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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MESH

D011276

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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MERCK INDEX

m9115

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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Merck Index

CAS

80-92-2

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

PRIMARY

EVMPD

SUB15006MIG

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

PRIMARY

PUBCHEM

219833

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

PRIMARY

ChEMBL

CHEMBL269897

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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ECHA (EC/EINECS)

201-313-7

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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SMS_ID

100000078869

Created by admin on Fri Dec 15 16:17:45 UTC 2023 , Edited by admin on Fri Dec 15 16:17:45 UTC 2023

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