α-amanitin (Q1752147)

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chemical compound

alpha-amanitin

Language	Label	Description	Also known as
English	α-amanitin	chemical compound	alpha-amanitin

Statements

type of chemical entity

0 references

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chemical structure

Alpha-amanitin structure.png
1,662 × 1,337; 46 KB

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918.354167 dalton

1 reference

language of work or name

alpha-amanitin (English)

5 October 2016

chemical formula

C₃₉H₅₄N₁₀O₁₄S

1 reference

language of work or name

alpha-amanitin (English)

20 November 2016

canonical SMILES

CCC(C)C1C(=O)NCC(=O)NC2CS(=O)C3=C(CC(C(=O)NCC(=O)N1)NC(=O)C(NC(=O)C4CC(CN4C(=O)C(NC2=O)CC(=O)N)O)C(C)C(CO)O)C5=C(N3)C=C(C=C5)O

1 reference

language of work or name

alpha-amanitin (English)

20 November 2016

isomeric SMILES

CC[C@H](C)[C@H]1C(=O)NCC(=O)N[C@H]2C[S@@](=O)C3=C(C[C@@H](C(=O)NCC(=O)N1)NC(=O)[C@@H](NC(=O)[C@@H]4C[C@H](CN4C(=O)[C@@H](NC2=O)CC(=O)N)O)[C@@H](C)[C@H](CO)O)C5=C(N3)C=C(C=C5)O

1 reference

language of work or name

alpha-amanitin (English)

20 November 2016

subject has role

DNA polymerase inhibitors

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

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Commons category

Alpha-Amanitin

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Identifiers

InChI=1S/C39H54N10O14S/c1-4-16(2)31-36(60)42-11-29(55)43-25-15-64(63)38-21(20-6-5-18(51)7-22(20)46-38)9-23(33(57)41-12-30(56)47-31)44-37(61)32(17(3)27(53)14-50)48-35(59)26-8-19(52)13-49(26)39(62)24(10-28(40)54)45-34(25)58/h5-7,16-17,19,23-27,31-32,46,50-53H,4,8-15H2,1-3H3,(H2,40,54)(H,41,57)(H,42,60)(H,43,55)(H,44,61)(H,45,58)(H,47,56)(H,48,59)/t16-,17-,19+,23-,24-,25-,26-,27-,31-,32-,64+/m0/s1

1 reference

language of work or name

alpha-amanitin (English)

20 November 2016

CIORWBWIBBPXCG-SXZCQOKQSA-N

2 references

language of work or name

alpha-amanitin (English)

20 November 2016

ChEBI release 2020-09-01

CAS Registry Number

1 reference

Global Substance Registration System

language of work or name

α-amanitin (English)

20 November 2016

1 reference

language of work or name

2-[(1R,4S,8R,10S,13S,16S,27R,34S)-34-[(2S)-2-Butanyl]-13-[(2R,3R)-3,4-dihydroxy-2-butanyl]-8,22-dihydroxy-27-oxido-2,5,11,14,30,33,36,39-octaoxo-27-thia-3,6,12,15,25,29,32,35,38-nonaazapentacyclo[14.1 (English)

20 November 2016

2 references

language of work or name

alpha-amanitin (English)

20 November 2016

matched by identifier from

CIORWBWIBBPXCG-SXZCQOKQSA-N

Reaxys registry number

1071138

1 reference

language of work or name

alpha-amanitin (English)

5 October 2016

mapping relation type

2 references

language of work or name

alpha-amanitin (English)

5 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C39H54N10O14S/c1-4-16(2)31-36(60)42-11-29(55)43-25-15-64(63)38-21(20-6-5-18(51)7-22(20)46-38)9-23(33(57)41-12-30(56)47-31)44-37(61)32(17(3)27(53)14-50)48-35(59)26-8-19(52)13-49(26)39(62)24(10-28(40)54)45-34(25)58/h5-7,16-17,19,23-27,31-32,46,50-53H,4,8-15H2,1-3H3,(H2,40,54)(H,41,57)(H,42,60)(H,43,55)(H,44,61)(H,45,58)(H,47,56)(H,48,59)/t16-,17-,19+,23-,24-,25-,26-,27-,31-,32-,64+/m0/s1

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

CIORWBWIBBPXCG-SXZCQOKQSA-N

UniChem compound ID

1 reference

0 references

1 reference

Hazardous Substances Data Bank

publication date

28 October 2019

ALPHA-AMANITIN (English)

10 May 2021

DSSTox substance ID

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DSSTOX compound identifier

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245-432-2

1 reference

Global Substance Registration System

language of work or name

α-amanitin (English)

20 November 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

α-Amanitin (English)

CAS no.: 23109-05-9 (English)

Guide to Pharmacology Ligand ID

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MeSH descriptor ID

subject named as

Alpha-Amanitin

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D04.345.566.050.111

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D12.644.456.050.111

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D12.644.641.050.111

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D23.946.587.175.111

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1 reference

language of work or name

alpha-amanitin (English)

5 October 2016

2 references

Global Substance Registration System

language of work or name

α-amanitin (English)

20 November 2016

matched by identifier from

CIORWBWIBBPXCG-SXZCQOKQSA-N

0 references

1 reference

6 April 2020

1 reference

Freebase Data Dumps

publication date

28 October 2013

Gran Enciclopèdia Catalana ID

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Gran Enciclopèdia Catalana ID (former scheme)

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Microsoft Academic ID

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1 reference

based on heuristic

inferred by common MeSH mappings on source and on Wikidata

24 May 2023

Sitelinks

Wikipedia(25 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:Alpha-Amanitin

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