C33H35N5O5
581.7 g/mol
APIDanger
Ergotamin
CAS113-15-5EC204-023-9
Category
API
Compound Class
Natural Product
Primary Use
Pharmaceutical Raw Material
Ergotamin is an alkaloid compound produced by Claviceps fungal species found on various grasses. It is used as an active pharmaceutical ingredient in medications.
pharmaceutical raw material for migraine medicationsvasoconstrictor agentserotonin receptor agonist
Content scope: Information here supports chemical identification and industrial supply, research, and manufacturing contexts. It is not a therapeutic claim, medical advice, or drug-use instructions.
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CAS 113-15-5
Related Compounds
SimilarStructure SimilarSimilarity 0.84
Ergocristine
CAS511-08-0
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Methylphenidate
CAS113-45-1
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Imipramine hydrochloride
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pharmaceutical raw material
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(Z)-chlorprothixene
CAS113-59-7
pharmaceutical raw material
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Gramicidin s
CAS113-73-5
pharmaceutical raw material
Safety Reference
Danger
H301Toxic if swallowed
H302Harmful if swallowed
H311Toxic in contact with skin
H312Harmful in contact with skin
H330Fatal if inhaled
H331Toxic if inhaled
H332Harmful if inhaled
H361Suspected of damaging fertility or the unborn child
Identifiers
IUPAC Name
(6aR,9R)-N-[(1S,2S,4R,7S)-7-benzyl-2-hydroxy-4-methyl-5,8-dioxo-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
InChIKey
XCGSFFUVFURLIX-VFGNJEKYSA-N
SMILES
C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4)NC(=O)[C@H]5CN([C@@H]6CC7=CNC8=CC=CC(=C78)C6=C5)C
Synonyms (25)
- ERM
- Ergotamina [INN-Spanish]
- Ergotamine (INN)
- Ergotaminum [INN-Latin]
- Ergo Kranit
- Ergomar
- Ergonsvine
- Ergotamin
- Ergotamin; ergotaminum
- Ergotamina
- Gynergen
- Mono, Ergodryl
- ergotaminum