nicergoline (Q2623398)

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chemical compound

(8beta)-10-methoxy-1,6-dimethylergoline-8-methanol 5-bromo-3-pyridinecarboxylate (ester)
10-methoxy-1,6-dimethylergoline-8beta-methanol 5-bromonicotinate

Language	Label	Description	Also known as
English	nicergoline	chemical compound	(8beta)-10-methoxy-1,6-dimethylergoline-8-methanol 5-bromo-3-pyridinecarboxylate (ester) 10-methoxy-1,6-dimethylergoline-8beta-methanol 5-bromonicotinate

Statements

type of chemical entity

0 references

5-bromo-3-pyridinecarboxylic acid (10a-methoxy-4,7-dimethyl-6a,8,9,10-tetrahydro-6H-indolo[4,3-fg]quinoline-9-yl)methyl ester

1 reference

based on heuristic

inferred from InChIKey

1 reference

Nicergoline (English)

language of work or name

publication date

17 November 2015

chemical structure

Nicergoline Structure V.1.svg
600 × 558; 51 KB

1 reference

imported from Wikimedia project

German Wikipedia

483.115754 dalton

1 reference

language of work or name

nicergoline (English)

4 October 2016

stereoisomer of

5-bromo-3-pyridinecarboxylic acid [(6aS,9R,10aS)-10a-methoxy-4,7-dimethyl-6a,8,9,10-tetrahydro-6H-indolo[4,3-fg]quinoline-9-yl]methyl ester

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₄H₂₆BrN₃O₃

1 reference

language of work or name

nicergoline (English)

19 November 2016

canonical SMILES

CN1CC(CC2(C1CC3=CN(C4=CC=CC2=C34)C)OC)COC(=O)C5=CC(=CN=C5)Br

1 reference

language of work or name

nicergoline (English)

19 November 2016

isomeric SMILES

CN1C[C@@H](C[C@]2([C@H]1CC3=CN(C4=CC=CC2=C34)C)OC)COC(=O)C5=CC(=CN=C5)Br

1 reference

language of work or name

nicergoline (English)

19 November 2016

route of administration

oral administration

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intravenous infusion and defusion

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intramuscular injection

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intra-arterial infusion

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subject has role

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Medical Subject Headings

MeSH descriptor ID

15 March 2018

vasodilator agent

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

Identifiers

InChI=1S/C24H26BrN3O3/c1-27-13-17-8-21-24(30-3,19-5-4-6-20(27)22(17)19)9-15(12-28(21)2)14-31-23(29)16-7-18(25)11-26-10-16/h4-7,10-11,13,15,21H,8-9,12,14H2,1-3H3/t15-,21-,24+/m1/s1

1 reference

language of work or name

nicergoline (English)

19 November 2016

YSEXMKHXIOCEJA-FVFQAYNVSA-N

2 references

language of work or name

nicergoline (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

nicergoline (English)

19 November 2016

YSEXMKHXIOCEJA-FVFQAYNVSA-N

CAS Common Chemistry

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=27848-84-6

1 reference

language of work or name

Nicergoline (English)

19 November 2016

2 references

language of work or name

nicergoline (English)

19 November 2016

matched by identifier from

YSEXMKHXIOCEJA-FVFQAYNVSA-N

Reaxys registry number

903548

1 reference

language of work or name

Nicergoline (English)

4 October 2016

mapping relation type

2 references

language of work or name

NICERGOLINE (English)

19 November 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C24H26BrN3O3/c1-27-13-17-8-21-24(30-3,19-5-4-6-20(27)22(17)19)9-15(12-28(21)2)14-31-23(29)16-7-18(25)11-26-10-16/h4-7,10-11,13,15,21H,8-9,12,14H2,1-3H3/t15-,21-,24+/m1/s1

1 reference

language of work or name

NICERGOLINE (English)

19 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

YSEXMKHXIOCEJA-FVFQAYNVSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-Waters-WA002676

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MSBNK-Waters-WA002677

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MSBNK-Waters-WA002678

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MSBNK-Waters-WA002679

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MSBNK-Waters-WA002680

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MSBNK-Waters-WA002681

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DSSTox substance ID

2 references

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

matched by identifier from

YSEXMKHXIOCEJA-FVFQAYNVSA-N

DSSTOX compound identifier

0 references

0 references

0 references

248-694-6

1 reference

Global Substance Registration System

language of work or name

nicergoline (English)

19 November 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

Nicergoline (English)

CAS no.: 27848-84-6 (English)

1 reference

language of work or name

Nicergoline (English)

publication date

17 November 2015

MeSH descriptor ID

subject named as

Nicergoline

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MeSH concept ID

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D03.132.327.287.730

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D03.633.400.439.730

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1 reference

Global Substance Registration System

language of work or name

nicergoline (English)

19 November 2016

1 reference

matched by identifier from

YSEXMKHXIOCEJA-FVFQAYNVSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

YSEXMKHXIOCEJA-FVFQAYNVSA-N

2 references

Global Substance Registration System

language of work or name

nicergoline (English)

19 November 2016

matched by identifier from

YSEXMKHXIOCEJA-FVFQAYNVSA-N

Probes And Drugs ID

0 references

1 reference

1 reference

language of work or name

Nicergoline (English)

4 October 2016

BNCF Thesaurus ID

1 reference

Nuovo soggettario

0 references

1 reference

Freebase Data Dumps

publication date

28 October 2013

Microsoft Academic ID

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Sitelinks

Wikipedia(13 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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