BioModels Ontology

Last uploaded: April 3, 2012
Preferred Name

dihydroergotamine mesylate

Synonyms
Definitions

The methanesulfonic acid salt of dihydroergotamine, a semisynthetic ergot alkaloid with weaker oxytocic and vasoconstrictor properties than ergotamine. Both the mesylate and the tartrate salts are used for the treatment of migraine and orthostatic hypotension.

ID

http://purl.obolibrary.org/obo/CHEBI_59756

alternative term

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

InChI=1S/C33H37N5O5.CH4O3S/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;1-5(2,3)4/h3-6,8-11,17,21,23,25-27,34,42H,7,12-16,18H2,1-2H3,(H,35,39);1H3,(H,2,3,4)/t21-,23-,25-,26+,27+,32-,33+;/m1./s1

9,10-dihydroergotamine methanesulfonate

InChIKey=ADYPXRFPBQGGAH-UMYZUSPBSA-N

C34H41N5O8S

dihydroergotamine monomethanesulfonate

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

dihydroergotamine mesilate

9,10-dihydroergotamine mesylate

dihydroergotamine methanesulfonate

CS(O)(=O)=O.[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

definition

The methanesulfonic acid salt of dihydroergotamine, a semisynthetic ergot alkaloid with weaker oxytocic and vasoconstrictor properties than ergotamine. Both the mesylate and the tartrate salts are used for the treatment of migraine and orthostatic hypotension.

has part

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

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 mesylate

prefixIRI

CHEBI:59756

prefLabel

dihydroergotamine mesylate

subClassOf

http://purl.obolibrary.org/obo/CHEBI_38037

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