norgestimate (Q7051181)

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chemical compound

ORF-10131
d-13beta-ethyl-17alpha-ethynyl-17beta-acetoxygon-4-en-3-one oxime
(17alpha)-17-(acetyloxy)-13-ethyl-18,19-dinorpregn-4-en-20-yn-3-one 3-oxime
(+)-13-ethyl-17-hydroxy-18,19-dinor-17alpha-pregn-4-en-20-yn-3-one oxime acetate (ester)
D-13beta-ethyl-17alpha-ethynyl-17beta-acetoxygon-4-en-3-one oxime

Language	Label	Description	Also known as
English	norgestimate	chemical compound	ORF-10131 d-13beta-ethyl-17alpha-ethynyl-17beta-acetoxygon-4-en-3-one oxime (17alpha)-17-(acetyloxy)-13-ethyl-18,19-dinorpregn-4-en-20-yn-3-one 3-oxime (+)-13-ethyl-17-hydroxy-18,19-dinor-17alpha-pregn-4-en-20-yn-3-one oxime acetate (ester) D-13beta-ethyl-17alpha-ethynyl-17beta-acetoxygon-4-en-3-one oxime

Statements

type of chemical entity

0 references

progesterone congener

1 reference

27 February 2018

0 references

image of molecular model or crystal lattice model

Norgestimate molecule ball.png
2,560 × 1,993; 1,006 KB

ball-and-stick model

0 references

369.230394 dalton

1 reference

language of work or name

NORGESTIMATE (English)

3 October 2016

chemical formula

C₂₃H₃₁NO₃

1 reference

language of work or name

NORGESTIMATE (English)

19 November 2016

canonical SMILES

CCC12CCC3C(C1CCC2(C#C)OC(=O)C)CCC4=CC(=NO)CCC34

1 reference

language of work or name

NORGESTIMATE (English)

19 November 2016

isomeric SMILES

CC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)OC(=O)C)CCC4=C/C(=N/O)/CC[C@H]34

1 reference

language of work or name

NORGESTIMATE (English)

19 November 2016

World Health Organisation international non-proprietary name

norgestimate (English)

1 reference

language of work or name

Norgestimate (English)

19 January 2016

medical condition treated

1 reference

language of work or name

13 December 2016

subject has role

synthetic oral contraceptives

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

1 reference

imported from Wikimedia project

English Wikipedia

Wikimedia import URL

https://en.wikipedia.org/w/index.php?title=Norgestimate&oldid=950660241

Commons category

Norgestimate

0 references

Identifiers

InChI=1S/C23H31NO3/c1-4-22-12-10-19-18-9-7-17(24-26)14-16(18)6-8-20(19)21(22)11-13-23(22,5-2)27-15(3)25/h2,14,18-21,26H,4,6-13H2,1,3H3/b24-17+/t18-,19+,20+,21-,22-,23-/m0/s1

1 reference

language of work or name

NORGESTIMATE (English)

19 November 2016

KIQQMECNKUGGKA-NMYWJIRASA-N

2 references

language of work or name

NORGESTIMATE (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

1 reference

Global Substance Registration System

language of work or name

norgestimate (English)

19 November 2016

1 reference

language of work or name

Norgestimate (English)

19 November 2016

2 references

language of work or name

NORGESTIMATE (English)

19 November 2016

matched by identifier from

KIQQMECNKUGGKA-NMYWJIRASA-N

mapping relation type

2 references

language of work or name

NORGESTIMATE (English)

19 November 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C23H31NO3/c1-4-22-12-10-19-18-9-7-17(24-26)14-16(18)6-8-20(19)21(22)11-13-23(22,5-2)27-15(3)25/h2,14,18-21,26H,4,6-13H2,1,3H3/b24-17+/t18-,19+,20+,21-,22-,23-/m0/s1

1 reference

language of work or name

NORGESTIMATE (English)

19 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

KIQQMECNKUGGKA-NMYWJIRASA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-Athens_Univ-AU280001

1 reference

KIQQMECNKUGGKA-NMYWJIRASA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU280002

1 reference

KIQQMECNKUGGKA-NMYWJIRASA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU280004

1 reference

KIQQMECNKUGGKA-NMYWJIRASA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU280005

1 reference

KIQQMECNKUGGKA-NMYWJIRASA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU280003

1 reference

KIQQMECNKUGGKA-NMYWJIRASA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

MSBNK-Athens_Univ-AU280006

1 reference

KIQQMECNKUGGKA-NMYWJIRASA-N

MassBank/MassBank-data: release version 2022.06 to wikidata

4 September 2022

based on heuristic

1 reference

Hazardous Substances Data Bank

publication date

28 October 2019

Norgestimate (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

KIQQMECNKUGGKA-NMYWJIRASA-N

DSSTOX compound identifier

0 references

0 references

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

(5E)-15-ethyl-14-ethynyl-5-(hydroxyimino)tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-en-14-yl acetate (English)

CAS no.: 35189-28-7 (English)

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

(5E)-15-ethyl-14-ethynyl-5-(hydroxyimino)tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-6-en-14-yl acetate (English)

CAS no.: 35189-28-7 (English)

Guide to Pharmacology Ligand ID

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

norgestimate (English)

19 November 2016

MeSH descriptor ID

1 reference

Medical Subject Headings

MeSH descriptor ID

14 March 2018

1 reference

Global Substance Registration System

language of work or name

norgestimate (English)

19 November 2016

1 reference

matched by identifier from

KIQQMECNKUGGKA-NMYWJIRASA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

KIQQMECNKUGGKA-NMYWJIRASA-N

1 reference

Global Substance Registration System

language of work or name

norgestimate (English)

19 November 2016

1 reference

matched by identifier from

KIQQMECNKUGGKA-NMYWJIRASA-N

1 reference

Global Substance Registration System

language of work or name

norgestimate (English)

19 November 2016

Probes And Drugs ID

0 references

1 reference

1 reference

language of work or name

norgestimate (English)

3 October 2016

0 references

Microsoft Academic ID

0 references

1 reference

Global Substance Registration System

language of work or name

norgestimate (English)

19 November 2016

1 reference

based on heuristic

inferred by common MeSH mappings on source and on Wikidata

25 May 2023

Sitelinks

Wikipedia(6 entries)

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:Norgestimate

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