anidulafungin (Q4764531)

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chemical compound

Eraxis
V-Echinocandin
(4R,5R)-4,5-Dihydroxy-N²-[[4''-(pentyloxy)-p-terphenyl-4-yl]carbonyl]-L-ornithyl-L-threonyl-trans-4-hydroxy-L-prolyl-(S)-4-hydroxy-4(p-hydroxyphenyl)-L-threonyl-L-threonyl-(3S,4S)-3-hydroxy-4-methyl-L-proline cyclic (6->1)-peptide
Anidulafungin
Anidulafungina
Anidulafungine
Anidulafunginum

Language	Label	Description	Also known as
English	anidulafungin	chemical compound	Eraxis V-Echinocandin (4R,5R)-4,5-Dihydroxy-N²-[[4''-(pentyloxy)-p-terphenyl-4-yl]carbonyl]-L-ornithyl-L-threonyl-trans-4-hydroxy-L-prolyl-(S)-4-hydroxy-4(p-hydroxyphenyl)-L-threonyl-L-threonyl-(3S,4S)-3-hydroxy-4-methyl-L-proline cyclic (6->1)-peptide Anidulafungin Anidulafungina Anidulafungine Anidulafunginum

Statements

type of chemical entity

0 references

1 reference

27 February 2018

1 reference

Anidulafungin (English)

language of work or name

publication date

17 November 2015

chemical structure

Anidulafungin structure.svg
512 × 382; 20 KB

0 references

1,139.506294 dalton

1 reference

language of work or name

Anidulafungin (English)

4 October 2016

chemical formula

C₅₈H₇₃N₇O₁₇

1 reference

language of work or name

Anidulafungin (English)

19 November 2016

canonical SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)NC4CC(C(NC(=O)C5C(C(CN5C(=O)C(NC(=O)C(NC(=O)C6CC(CN6C(=O)C(NC4=O)C(C)O)O)C(C(C7=CC=C(C=C7)O)O)O)C(C)O)C)O)O)O

1 reference

language of work or name

Anidulafungin (English)

19 November 2016

isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)C(=O)N[C@H]4C[C@H]([C@H](NC(=O)[C@@H]5[C@H]([C@H](CN5C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]6C[C@H](CN6C(=O)[C@@H](NC4=O)[C@@H](C)O)O)[C@@H]([C@H](C7=CC=C(C=C7)O)O)O)[C@@H](C)O)C)O)O)O

1 reference

language of work or name

Anidulafungin (English)

19 November 2016

defined daily dose

0.1 gram

route of administration

parenteral route of administration

1 reference

https://www.whocc.no/atc_ddd_index/?code=J02AX06

active ingredient in

1 reference

European Medicines Agency product number

EMEA/H/C/000788

http://www.ema.europa.eu/ema/index.jsp?curl=pages/medicines/human/medicines/000788/human_med_000751.jsp

22 March 2017

1 reference

14 February 2018

World Health Organisation international non-proprietary name

anidulafungin (English)

1 reference

language of work or name

anidulafungin (English)

4 October 2016

1 reference

Deacylation of Echinocandin B by Streptomyces species: a novel method for the production of Echinocandin B nucleus

medical condition treated

esophageal candidiasis

17 February 2006

Food and Drug Administration

1 reference

Inxight: Drugs Database

2 November 2018

https://drugs.ncats.io/drug/9HLM53094I

http://www.accessdata.fda.gov/drugsatfda_docs/label/2012/021632s011lbl.pdf

pregnancy category

US pregnancy category B

1 reference

imported from Wikimedia project

English Wikipedia

subject has role

enzyme inhibitor

1 reference

5 March 2018

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

Commons category

Anidulafungin

0 references

Identifiers

InChI=1S/C58H73N7O17/c1-5-6-7-24-82-40-22-18-35(19-23-40)33-10-8-32(9-11-33)34-12-14-37(15-13-34)51(74)59-41-26-43(70)54(77)63-56(79)47-48(71)29(2)27-65(47)58(81)45(31(4)67)61-55(78)46(50(73)49(72)36-16-20-38(68)21-17-36)62-53(76)42-25-39(69)28-64(42)57(80)44(30(3)66)60-52(41)75/h8-23,29-31,39,41-50,54,66-73,77H,5-7,24-28H2,1-4H3,(H,59,74)(H,60,75)(H,61,78)(H,62,76)(H,63,79)/t29-,30+,31+,39+,41-,42-,43+,44-,45-,46-,47-,48-,49-,50-,54+/m0/s1

0 references

JHVAMHSQVVQIOT-MFAJLEFUSA-N

2 references

language of work or name

Anidulafungin (English)

19 November 2016

ChEBI release 2020-09-01

CAS Registry Number

1 reference

Global Substance Registration System

language of work or name

anidulafungin (English)

19 November 2016

1 reference

language of work or name

Anidulafungin (English)

19 November 2016

2 references

language of work or name

Anidulafungin (English)

19 November 2016

matched by identifier from

JHVAMHSQVVQIOT-MFAJLEFUSA-N

Reaxys registry number

7408417

1 reference

language of work or name

anidulafungin (English)

4 October 2016

mapping relation type

2 references

language of work or name

ANIDULAFUNGIN (English)

19 November 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C58H73N7O17/c1-5-6-7-24-82-40-22-18-35(19-23-40)33-10-8-32(9-11-33)34-12-14-37(15-13-34)51(74)59-41-26-43(70)54(77)63-56(79)47-48(71)29(2)27-65(47)58(81)45(31(4)67)61-55(78)46(50(73)49(72)36-16-20-38(68)21-17-36)62-53(76)42-25-39(69)28-64(42)57(80)44(30(3)66)60-52(41)75/h8-23,29-31,39,41-50,54,66-73,77H,5-7,24-28H2,1-4H3,(H,59,74)(H,60,75)(H,61,78)(H,62,76)(H,63,79)/t29-,30+,31+,39+,41-,42-,43+,44-,45-,46-,47-,48-,49-,50-,54+/m0/s1

1 reference

language of work or name

ANIDULAFUNGIN (English)

19 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

JHVAMHSQVVQIOT-MFAJLEFUSA-N

UniChem compound ID

1 reference

DSSTox substance ID

0 references

DSSTOX compound identifier

0 references

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

1-[(4R,5R)-4,5-Dihydroxy-N2-[[4"-(pentyloxy)[1,1':4',1"-terphenyl]-4-yl]carbonyl] -L-ornithine (English)

CAS no.: 166663-25-8 (English)

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

1-[(4R,5R)-4,5-Dihydroxy-N2-[[4"-(pentyloxy)[1,1':4',1"-terphenyl]-4-yl]carbonyl] -L-ornithine (English)

CAS no.: 166663-25-8 (English)

1 reference

language of work or name

Anidulafungin (English)

publication date

17 November 2015

MeSH descriptor ID

subject named as

Anidulafungin

0 references

D12.644.641.311.250

0 references

1 reference

Global Substance Registration System

language of work or name

anidulafungin (English)

19 November 2016

1 reference

matched by identifier from

JHVAMHSQVVQIOT-MFAJLEFUSA-N

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

JHVAMHSQVVQIOT-MFAJLEFUSA-N

2 references

Global Substance Registration System

language of work or name

anidulafungin (English)

19 November 2016

matched by identifier from

JHVAMHSQVVQIOT-MFAJLEFUSA-N

1 reference

Global Substance Registration System

language of work or name

anidulafungin (English)

19 November 2016

Probes And Drugs ID

0 references

1 reference

language of work or name

anidulafungin (English)

4 October 2016

1 reference

6 April 2020

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

anidulafungin (English)

19 November 2016

1 reference

based on heuristic

inferred by common MeSH mappings on source and on Wikidata

25 May 2023

WikiProjectMed ID

0 references

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(1 entry)

commonswiki Category:Anidulafungin

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