BioModels Ontology

Last uploaded: April 3, 2012
Preferred Name

dihydroergotamine

Synonyms
Definitions

Ergotamine in which a single bond replaces the double bond between positions 9 and 10. A semisynthetic ergot alkaloid with weaker oxytocic and vasoconstrictor properties than ergotamine, it is used (as the methanesulfonic or tartaric acid salts) for the treatment of migraine and orthostatic hypotension.

ID

http://purl.obolibrary.org/obo/CHEBI_4562

alternative term

dihydroergotaminum

dihidroergotamina

9,10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)ergotoman-3',6',18-trione

ergotamine

9,10-dihydroergotamine

dihydroergotamine

(10alphaH)-5'alpha-benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxo-9,10-dihydroergotaman

(5'alpha)-12'-hydroxy-2'-methyl-5'-(phenylmethyl)ergotoman-3',6',18-trione

(5'alpha)-5'-benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxoergotaman

InChI=1S/C33H37N5O5/c1-32(35-29(39)21-15-23-22-10-6-11-24-28(22)20(17-34-24)16-25(23)36(2)18-21)31(41)38-26(14-19-8-4-3-5-9-19)30(40)37-13-7-12-27(37)33(38,42)43-32/h3-6,8-11,17,21,23,25-27,34,42H,7,12-16,18H2,1-2H3,(H,35,39)/t21-,23-,25-,26+,27+,32-,33+/m1/s1

5'-benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxo-9,10-dihydroergotaman

InChIKey=LUZRJRNZXALNLM-JGRZULCMSA-N

ergotamina

[H][C@@]12Cc3c[nH]c4cccc(c34)[C@@]1([H])C[C@H](CN2C)C(=O)N[C@]1(C)O[C@]2(O)N([C@@H](Cc3ccccc3)C(=O)N3CCC[C@@]23[H])C1=O

Ergotamin

ergotaminum

Ergotamine

12'-hydroxy-2'-methyl-5'alpha-(phenylmethyl)ergotaman-3',6',18-trione

Dihydroergotamine

definition

Ergotamine in which a single bond replaces the double bond between positions 9 and 10. A semisynthetic ergot alkaloid with weaker oxytocic and vasoconstrictor properties than ergotamine, it is used (as the methanesulfonic or tartaric acid salts) for the treatment of migraine and orthostatic hypotension.

has role

http://purl.obolibrary.org/obo/CHEBI_35941

http://purl.obolibrary.org/obo/CHEBI_35481

http://purl.obolibrary.org/obo/CHEBI_50514

label

dihydroergotamine

prefixIRI

CHEBI:4562

prefLabel

dihydroergotamine

subClassOf

http://purl.obolibrary.org/obo/CHEBI_23943

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http://purl.obolibrary.org/obo/CHEBI_4562 CHEBI SAME_URI
http://purl.obolibrary.org/obo/CHEBI_4562 FIDEO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_4562 DINTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_4562 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_4562 DRON SAME_URI
http://purl.obolibrary.org/obo/CHEBI_4562 NIFSTD SAME_URI
http://purl.obolibrary.org/obo/CHEBI_4562 CHEBI LOOM
https://go.drugbank.com/drugs/DB00320 MDM LOOM
http://stirdf.jst.go.jp/id/200907007411681909 IOBC LOOM
http://purl.bioontology.org/ontology/VANDF/4019721 VANDF LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D004087 RH-MESH LOOM
http://purl.bioontology.org/ontology/MESH/D004087 MESH LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.549.562.300 RH-MESH LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C65387 NCIT LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/387267005 SNOMEDCT LOOM
http://ontology.apa.org/apaonto/termsonlyOUT%20(5).owl#Dihydroergotamine APAONTO LOOM
http://purl.jp/bio/4/id/200906034010187530 IOBC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#3949 OCHV LOOM
http://purl.bioontology.org/ontology/SNMI/C-68410 SNMI LOOM
http://purl.obolibrary.org/obo/NCIT_C65387 BERO LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D03.132.327.412.225 RH-MESH LOOM
http://purl.obolibrary.org/obo/MESH_D004087 BERO LOOM
http://purl.obolibrary.org/obo/OMIT_0005353 OMIT LOOM
http://purl.bioontology.org/ontology/RXNORM/3418 RXNORM LOOM
http://purl.bioontology.org/ontology/ATC/N02CA01 ATC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0012291 OCHV LOOM
http://purl.bioontology.org/ontology/RCD/dlB.. RCD LOOM
http://purl.obolibrary.org/obo/CHEBI_4826 NIFSTD LOOM
http://www.co-ode.org/ontologies/galen#Dihydroergotamine GALEN LOOM
http://www.phoc.org.cn/pmo/class/PMO_00018014 PMAPP-PMO LOOM
http://www.drugbank.ca/drugs/DB00320 FTC LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147813 NDFRT LOOM
http://purl.obolibrary.org/obo/CHEBI_4562 FIDEO LOOM
http://purl.obolibrary.org/obo/CHEBI_4562 DINTO LOOM
http://purl.obolibrary.org/obo/CHEBI_4562 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_4562 NIFSTD LOOM