ergovaline (Q5385834)

(6aS,9R)-N-[(1S,2S,4R,7S)-2-hydroxy-4-methyl-5,8-dioxo-7-propan-2-yl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide

Ergovaline (English)

13 October 2016

1 reference

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₉H₃₅N₅O₅

1 reference

Ergovaline (English)

13 October 2016

CC(C)C1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C)NC(=O)C4CN(C5CC6=CNC7=CC=CC(=C67)C5=C4)C)O

1 reference

Ergovaline (English)

13 October 2016

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

1 reference

Ergot alkaloid identification in clavicipitaceae systemic fungi of pasture grasses

Ergovaline (English)

13 October 2016

1 reference

Cenchrus echinatus

1 reference

Ergobalansine, a New Ergot-Type Peptide Alkaloid Isolated from Cenchrus echinatus (Sandbur Grass) Infected with Balansia obtecta, and Produced in Liquid Cultures of B. obtecta and Balansia cyperi

Claviceps purpurea

1 reference

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

Festuca arundinacea

2 references

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

Analysis of ergopeptine alkaloids in endophyte-infected tall fescue

Epichloe festucae var. lolii

1 reference

A complex ergovaline gene cluster in epichloe endophytes of grasses

Festuca rubra

2 references

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

Analysis of ergopeptine alkaloids in endophyte-infected tall fescue

subject has role

vasoconstrictor agents

1 reference

InChI=1S/C29H35N5O5/c1-15(2)24-26(36)33-10-6-9-22(33)29(38)34(24)27(37)28(3,39-29)31-25(35)17-11-19-18-7-5-8-20-23(18)16(13-30-20)12-21(19)32(4)14-17/h5,7-8,11,13,15,17,21-22,24,30,38H,6,9-10,12,14H2,1-4H3,(H,31,35)/t17-,21-,22+,24+,28-,29+/m1/s1

Medical Subject Headings

15 March 2018

Ergovaline

0 references

Identifiers

InChI

1 reference

Ergovaline (English)

13 October 2016

1 reference

Global Substance Registration System

Ergovaline (English)

13 October 2016

2 references

UNII

059E2O9IV4

ergovaline (English)

13 October 2016

https://commonchemistry.cas.org/detail?cas_rn=2873-38-3

10 April 2021

1 reference

Ergovaline (English)

13 October 2016

2 references

matched by identifier from

English

title

Ergovaline (English)

retrieved

13 October 2016

InChIKey

ChEBI ID

184047

mapping relation type

exact match

2 references

matched by identifier from

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C29H35N5O5/c1-15(2)24-26(36)33-10-6-9-22(33)29(38)34(24)27(37)28(3,39-29)31-25(35)17-11-19-18-7-5-8-20-23(18)16(13-30-20)12-21(19)32(4)14-17/h5,7-8,11,13,15,17,21-22,24,30,38H,6,9-10,12,14H2,1-4H3,(H,31,35)/t17-,21-,22+,24+,28-,29+/m1/s1

1 reference

MassBank accession ID

0 references

0 references

0 references

0 references

0 references

0 references

DSSTOX compound identifier

0 references

1 reference

Medical Subject Headings

14 March 2018

2 references

Global Substance Registration System

UNII

059E2O9IV4

matched by identifier from

English

title

ergovaline (English)

retrieved

13 October 2016

InChIKey

inferred by common MeSH mappings on source and on Wikidata

Freebase ID

/m/0537sss

0 references

Microsoft Academic ID

0 references

1 reference