mestranol (Q904308)

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chemical compound

EE3-ME
17-ethynyl-3-methoxyoestra-1(10),2,4-trien-17beta-ol
(+)-17alpha-Ethynyl-17beta-hydroxy-3-methoxy-1,3,5(10)-oestratriene
(+)-17alpha-Ethynyl-17beta-hydroxy-3-methoxy-1,3,5(10)-estratriene
3-Methoxy-17alpha-ethynylestradiol
Ethynylestradiol 3-methyl ether
3-Methoxy-19-norpregna-1,3,5(10)-trien-20-yn-17beta-ol
Mestranol

Language	Label	Description	Also known as
English	mestranol	chemical compound	EE3-ME 17-ethynyl-3-methoxyoestra-1(10),2,4-trien-17beta-ol (+)-17alpha-Ethynyl-17beta-hydroxy-3-methoxy-1,3,5(10)-oestratriene (+)-17alpha-Ethynyl-17beta-hydroxy-3-methoxy-1,3,5(10)-estratriene 3-Methoxy-17alpha-ethynylestradiol Ethynylestradiol 3-methyl ether 3-Methoxy-19-norpregna-1,3,5(10)-trien-20-yn-17beta-ol Mestranol

Statements

type of chemical entity

0 references

(13S,17R)-17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol

1 reference

based on heuristic

inferred from SMILES

0 references

chemical structure

Mestranol.svg
512 × 344; 4 KB

1 reference

imported from Wikimedia project

German Wikipedia

310.19328 dalton

1 reference

language of work or name

mestranol (English)

3 October 2016

stereoisomer of

(8R,9S,13S,14R,17R)-17-ethynyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

chemical formula

C₂₁H₂₆O₂

1 reference

language of work or name

mestranol (English)

19 November 2016

canonical SMILES

CC12CCC3C(C1CCC2(C#C)O)CCC4=C3C=CC(=C4)OC

1 reference

language of work or name

mestranol (English)

19 November 2016

isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C3C=CC(=C4)OC

1 reference

language of work or name

mestranol (English)

19 November 2016

World Health Organisation international non-proprietary name

mestranol (English)

1 reference

language of work or name

mestranol (English)

3 October 2016

Cunninghamella elegans

1 reference

Microbial transformation of mestranol by Cunninghamella elegans.

subject has role

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

1 reference

California Proposition 65 list of chemicals

18 March 2020

https://oehha.ca.gov/chemicals/mestranol

Commons category

Mestranol

0 references

Identifiers

InChI=1S/C21H26O2/c1-4-21(22)12-10-19-18-7-5-14-13-15(23-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,6,8,13,17-19,22H,5,7,9-12H2,2-3H3/t17-,18-,19+,20+,21+/m1/s1

1 reference

language of work or name

mestranol (English)

19 November 2016

IMSSROKUHAOUJS-MJCUULBUSA-N

2 references

language of work or name

mestranol (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

mestranol (English)

19 November 2016

IMSSROKUHAOUJS-MJCUULBUSA-N

CAS Common Chemistry

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=72-33-3

1 reference

language of work or name

mestranol (English)

19 November 2016

1 reference

language of work or name

mestranol (English)

19 November 2016

Reaxys registry number

2625905

1 reference

language of work or name

mestranol (English)

3 October 2016

mapping relation type

2 references

language of work or name

MESTRANOL (English)

19 November 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C21H26O2/c1-4-21(22)12-10-19-18-7-5-14-13-15(23-3)6-8-16(14)17(18)9-11-20(19,21)2/h1,6,8,13,17-19,22H,5,7,9-12H2,2-3H3/t17-,18-,19+,20+,21+/m1/s1

1 reference

language of work or name

MESTRANOL (English)

19 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

IMSSROKUHAOUJS-MJCUULBUSA-N

UniChem compound ID

1 reference

splash10-01t9-1972000000-5e394201ba0e38e5391f

0 references

1 reference

Hazardous Substances Data Bank

publication date

28 October 2019

MESTRANOL (English)

10 May 2021

DSSTox substance ID

2 references

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

matched by identifier from

IMSSROKUHAOUJS-MJCUULBUSA-N

DSSTOX compound identifier

0 references

0 references

0 references

1 reference

Global Substance Registration System

language of work or name

mestranol (English)

19 November 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

Mestranol (English)

CAS no.: 72-33-3 (English)

OSHA Occupational Chemical Database ID

0 references

PesticideInfo chemical ID

0 references

Guide to Pharmacology Ligand ID

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

mestranol (English)

19 November 2016

MeSH descriptor ID

subject named as

Mestranol

0 references

D04.210.500.668.651.568.291.500

0 references

D06.472.334.851.437.968.500.500

0 references

1 reference

Global Substance Registration System

language of work or name

mestranol (English)

19 November 2016

1 reference

matched by identifier from

IMSSROKUHAOUJS-MJCUULBUSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

IMSSROKUHAOUJS-MJCUULBUSA-N

2 references

Global Substance Registration System

language of work or name

mestranol (English)

19 November 2016

matched by identifier from

IMSSROKUHAOUJS-MJCUULBUSA-N

1 reference

Global Substance Registration System

language of work or name

mestranol (English)

19 November 2016

Probes And Drugs ID

0 references

1 reference

1 reference

language of work or name

mestranol (English)

3 October 2016

1 reference

language of work or name

mestranol (English)

3 October 2016

1 reference

California Proposition 65 list of chemicals

6 January 2020

https://oehha.ca.gov/chemicals/mestranol

0 references

Encyclopædia Britannica Online ID

science/mestranol

subject named as

mestranol

0 references

0 references

Microsoft Academic ID

0 references

1 reference

26 January 2022

https://docs.openalex.org/download-snapshot/snapshot-data-format

1 reference

Global Substance Registration System

language of work or name

mestranol (English)

19 November 2016

WordNet 3.1 Synset ID

14775395-n

1 reference

Sitelinks

Wikipedia(9 entries)

dewiki Mestranol
enwiki Mestranol
fawiki مسترانول
mswiki Mestranol
ptwiki Mestranol
shwiki Mestranol
srwiki Mestranol
viwiki Mestranol
zhwiki 美雌醇

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(1 entry)

commonswiki Category:Mestranol

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