α-ergocryptine (Q5385811)

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chemical compound

12'-hydroxy-2'-(1-methylethyl)-5'alpha-(2-methylpropyl)ergotaman-3',6',18-trione
12'-hydroxy-5'alpha-isobutyl-2'-isopropylergotaman-3',6',18-trione

Language	Label	Description	Also known as
English	α-ergocryptine	chemical compound	12'-hydroxy-2'-(1-methylethyl)-5'alpha-(2-methylpropyl)ergotaman-3',6',18-trione 12'-hydroxy-5'alpha-isobutyl-2'-isopropylergotaman-3',6',18-trione

Statements

type of chemical entity

0 references

(4R,7R)-N-[(1S)-2-hydroxy-4-isopropyl-7-(2-methylpropyl)-5,8-dioxo-3-oxa-6,9-diazatricyclo[7.3.0.0²,⁶]dodecan-4-yl]-6-methyl-6,11-diazatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-1(16),2,9,12,14-pentaene-4-carboximidic acid

1 reference

based on heuristic

inferred from SMILES

chemical structure

Ergocryptine.svg
512 × 445; 10 KB

0 references

575.310769±0 dalton

1 reference

language of work or name

alpha-Ergocryptine (English)

3 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₂H₄₁N₅O₅

1 reference

language of work or name

alpha-Ergocryptine (English)

3 October 2016

canonical SMILES

CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O

1 reference

language of work or name

alpha-Ergocryptine (English)

3 October 2016

isomeric SMILES

CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@H]4CN([C@@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O

1 reference

language of work or name

alpha-Ergocryptine (English)

3 October 2016

Claviceps purpurea

6 references

Isolation of ergovaline, ergoptine, and ergonine, new alkaloids of the peptide type, from ergot sclerotia

Separation of ergot alkaloids and their epimers and determination in sclerotia by capillary electrophoresis

New Alkaloids From a Saprophytic Culture of Claviceps purpurea

Two Unusual Ergopeptines Produced by a Saprophytic Culture of Claviceps purpurea

Long-Term Production of Ergot Peptides by Immobilized Claviceps purpurea in Semicontinuous and Continuous Culture

Production of beta-ergokryptine by a strain of Claviceps purpurea (Fr.) Tul. in submerged culture

Claviceps grohii

1 reference

Claviceps nigricans and Claviceps grohii: their alkaloids and phylogenetic placement

Festuca arundinacea

1 reference

Detection of ergopeptine alkaloids in endophyte-infected, toxic Ky-31 tall fescue by mass spectrometry/mass spectrometry

Claviceps zizaniae

2 references

Ergot alkaloids produced by submerged cultures of Claviceps zizaniae.

Ergot alkaloids produced by submerged cultures of Claviceps zizaniae.

1 reference

Detection of ergopeptine alkaloids in endophyte-infected, toxic Ky-31 tall fescue by mass spectrometry/mass spectrometry

subject has role

dopamine agonist

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

Commons category

Ergocryptine

0 references

Identifiers

InChI=1S/C32H41N5O5/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20/h6,8-9,13,15,17-18,20,24-26,33,41H,7,10-12,14,16H2,1-5H3,(H,34,38)/t20-,24-,25+,26+,31-,32+/m1/s1

1 reference

language of work or name

alpha-Ergocryptine (English)

3 October 2016

YDOTUXAWKBPQJW-NSLWYYNWSA-N

2 references

language of work or name

alpha-Ergocryptine (English)

3 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

alpha-ergocryptine (English)

3 October 2016

YDOTUXAWKBPQJW-NSLWYYNWSA-N

CAS Common Chemistry

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=511-09-1

1 reference

language of work or name

Ergocryptine (English)

3 October 2016

2 references

language of work or name

alpha-Ergocryptine (English)

3 October 2016

matched by identifier from

YDOTUXAWKBPQJW-NSLWYYNWSA-N

Reaxys registry number

78810

1 reference

language of work or name

alpha-ergocryptine (English)

3 October 2016

mapping relation type

2 references

language of work or name

alpha-ergocryptine (English)

3 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C32H41N5O5/c1-17(2)12-25-29(39)36-11-7-10-26(36)32(41)37(25)30(40)31(42-32,18(3)4)34-28(38)20-13-22-21-8-6-9-23-27(21)19(15-33-23)14-24(22)35(5)16-20/h6,8-9,13,15,17-18,20,24-26,33,41H,7,10-12,14,16H2,1-5H3,(H,34,38)/t20-,24-,25+,26+,31-,32+/m1/s1

1 reference

language of work or name

ERGOCRYPTINE (English)

3 October 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

YDOTUXAWKBPQJW-NSLWYYNWSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-AAFC-AC000337

0 references

MSBNK-AAFC-AC000338

0 references

MSBNK-AAFC-AC000339

0 references

MSBNK-AAFC-AC000340

0 references

MSBNK-AAFC-AC000341

0 references

splash10-0aor-0041090000-feafc744d8bb98ef187e

0 references

DSSTox substance ID

0 references

DSSTOX compound identifier

DTXCID101323177

0 references

0 references

0 references

1 reference

Global Substance Registration System

language of work or name

.ALPHA.-ERGOCRYPTINE (English)

3 October 2016

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

12'-hydroxy-5'α-isobutyl-2'-isopropylergotaman-3',6',18-trione (English)

CAS no.: 511-09-1 (English)

Guide to Pharmacology Ligand ID

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

language of work or name

α-ergocryptine (English)

3 October 2016

MeSH descriptor ID

1 reference

Medical Subject Headings

MeSH descriptor ID

14 March 2018

1 reference

language of work or name

alpha-ergocryptine (English)

3 October 2016

2 references

Global Substance Registration System

language of work or name

.ALPHA.-ERGOCRYPTINE (English)

3 October 2016

matched by identifier from

YDOTUXAWKBPQJW-NSLWYYNWSA-N

Natural Product Atlas ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

YDOTUXAWKBPQJW-NSLWYYNWSA-N

Probes And Drugs ID

0 references

1 reference

1 reference

language of work or name

alpha-ergocryptine (English)

3 October 2016

0 references

Microsoft Academic ID

0 references

Sitelinks

Wikipedia(4 entries)

enwiki Ergocryptine
eowiki Ergokriptino
shwiki Ergokriptin
srwiki Ergokriptin

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:Ergocryptine

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