17α-estradiol (Q4721888)

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chemical compound

alpha-estradiol
Estra-1,3,5(10)-triene-3,17a-diol
Oestra-1,3,5(10)-triene-3,17a-diol
17a-Oestradiol
3,17a-Dihydroxyoestra-1,3,5(10)-triene
Epiestradiol
3,17-Dihydroxyestratriene
13b-Methyl-1,3,5(10)-gonatriene-3,17a-diol
Epiestrol
a-Estradiol
17-Epiestradiol
1,3,5-Estratriene-3,17a-diol
3,17a-Dihydroxyestra-1,3,5(10)-triene
(1S,10R,11S,14R,15S)-15-methyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2,4,6-triene-5,14-diol
Alfatradiol
17alpha-estradiol
17α-E2
17-epiestradiol
estra-1,3,5(10)-triene-3,17α-diol
estradiol

Language	Label	Description	Also known as
English	17α-estradiol	chemical compound	alpha-estradiol Estra-1,3,5(10)-triene-3,17a-diol Oestra-1,3,5(10)-triene-3,17a-diol 17a-Oestradiol 3,17a-Dihydroxyoestra-1,3,5(10)-triene Epiestradiol 3,17-Dihydroxyestratriene 13b-Methyl-1,3,5(10)-gonatriene-3,17a-diol Epiestrol a-Estradiol 17-Epiestradiol 1,3,5-Estratriene-3,17a-diol 3,17a-Dihydroxyestra-1,3,5(10)-triene (1S,10R,11S,14R,15S)-15-methyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadeca-2,4,6-triene-5,14-diol Alfatradiol 17alpha-estradiol 17α-E2 17-epiestradiol estra-1,3,5(10)-triene-3,17α-diol estradiol

Statements

type of chemical entity

0 references

0 references

chemical structure

Alfatradiol skeletal.svg
512 × 322; 4 KB

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image of molecular model or crystal lattice model

Alfatradiol 3D ball.png
2,000 × 1,344; 401 KB

ball-and-stick model

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272.17763 dalton

1 reference

language of work or name

Epiestradiol (English)

5 October 2016

chemical formula

C₁₈H₂₄O₂

1 reference

language of work or name

Epiestradiol (English)

19 November 2016

canonical SMILES

CC12CCC3C(C1CCC2O)CCC4=C3C=CC(=C4)O

1 reference

language of work or name

Epiestradiol (English)

19 November 2016

isomeric SMILES

C[C@]12CC[C@H]3[C@@H](CCC4=CC(O)=CC=C34)[C@@H]1CC[C@H]2O

1 reference

Global Substance Registration System

14 February 2018

active ingredient in

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World Health Organisation international non-proprietary name

alfatradiol (English)

1 reference

language of work or name

17alpha-estradiol (English)

5 October 2016

pregnancy category

US pregnancy category C

1 reference

imported from Wikimedia project

English Wikipedia

subject has role

dermatologic drug

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

5-alpha-reductase inhibitors

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

NCI Thesaurus ID

C81622

1 reference

Global Substance Registration System

14 February 2018

0 references

Identifiers

InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17-,18+/m1/s1

1 reference

language of work or name

Epiestradiol (English)

19 November 2016

VOXZDWNPVJITMN-SFFUCWETSA-N

2 references

language of work or name

Epiestradiol (English)

19 November 2016

Global Substance Registration System

14 February 2018

CAS Registry Number

2 references

Global Substance Registration System

14 February 2018

VOXZDWNPVJITMN-SFFUCWETSA-N

CAS Common Chemistry

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=57-91-0

1 reference

language of work or name

alfatradiol (English)

19 November 2016

2 references

language of work or name

Epiestradiol (English)

19 November 2016

matched by identifier from

VOXZDWNPVJITMN-SFFUCWETSA-N

Reaxys registry number

2698044

1 reference

language of work or name

17alpha-estradiol (English)

5 October 2016

2190991

0 references

mapping relation type

3 references

language of work or name

ALFATRADIOL (English)

19 November 2016

ChEBI release 2021-03-01

matched by identifier from

International Chemical Identifier

InChI=1S/C18H24O2/c1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20/h3,5,10,14-17,19-20H,2,4,6-9H2,1H3/t14-,15-,16+,17-,18+/m1/s1

1 reference

language of work or name

ALFATRADIOL (English)

19 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

VOXZDWNPVJITMN-SFFUCWETSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-Athens_Univ-AU281701

1 reference

VOXZDWNPVJITMN-SFFUCWETSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU281703

1 reference

VOXZDWNPVJITMN-SFFUCWETSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU281704

1 reference

VOXZDWNPVJITMN-SFFUCWETSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU281706

1 reference

VOXZDWNPVJITMN-SFFUCWETSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU281702

1 reference

VOXZDWNPVJITMN-SFFUCWETSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU281705

1 reference

VOXZDWNPVJITMN-SFFUCWETSA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

splash10-0a59-7900000000-0dae6df990a37c6c3fb3

0 references

splash10-0a4i-8900000000-956bcdeac1a836c6b83c

0 references

splash10-00p0-3970000000-ea6c869f7a3556f5fb55

0 references

splash10-00di-2950000000-9cd3211b8fd922d6f32b

0 references

DSSTox substance ID

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

matched by identifier from

VOXZDWNPVJITMN-SFFUCWETSA-N

DSSTOX compound identifier

0 references

0 references

200-354-8

1 reference

Global Substance Registration System

14 February 2018

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

Estra-1,3,5(10)-triene-3,17α-diol (English)

CAS no.: 57-91-0 (English)

MeSH descriptor ID

1 reference

Medical Subject Headings

MeSH descriptor ID

14 March 2018

1 reference

Global Substance Registration System

14 February 2018

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

VOXZDWNPVJITMN-SFFUCWETSA-N

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

VOXZDWNPVJITMN-SFFUCWETSA-N

2 references

Global Substance Registration System

14 February 2018

matched by identifier from

VOXZDWNPVJITMN-SFFUCWETSA-N

Probes And Drugs ID

0 references

1 reference

language of work or name

17alpha-estradiol (English)

5 October 2016

0 references

1 reference

matched by identifier from

VOXZDWNPVJITMN-SFFUCWETSA-N

Google Knowledge Graph ID

0 references

ScienceDirect topic ID

medicine-and-dentistry/17alpha-estradiol

0 references

Sitelinks

Wikipedia(3 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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