Anodyne

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DHE
Generated by the Chemistry Development Kit (http://github.com/cdk)
Molecular structure via molpic based on CDK
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Physical properties
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583.7 g/mol [1]
Solubility2.29e-01 g/L [1]
2.4 [1]
Structural Identifiers
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C33H37N5O5 [1]
(6aR,9R,10aR)-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,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide [1]
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]5C[C@H]6[C@@H](CC7=CNC8=CC=CC6=C78)N(C5)C [1]
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 [1]
InChIKeyLUZRJRNZXALNLM-JGRZULCMSA-N [1]

Dihydroergotamine

Dihydroergotamine (also known as 9,10-Dihydroergotamine, Dihidroergotamina, Dihydroergotaminum, Neomigran, Diidroergotamina, Agit, MAP0004, MAP-0004, 5'-Benzyl-12'-hydroxy-2'-methyl-3',6',18-trioxo-9,10-dihydroergotaman or 9,10-Dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)ergotoman-3',6',18-trione)

Chemistry

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Dihydroergotamine is a achiral mixture

Stereoisomers
(R)-DihydroergotamineGenerated by the Chemistry Development Kit (http://github.com/cdk)

See also []

  • Anodyne

    • External links []

    References []

    1. National Center for Biotechnology Information. PubChem Compound Summary for CID 10531, Dihydroergotamine. Accessed July 27, 2025. https://pubchem.ncbi.nlm.nih.gov/compound/10531