Dihydro-a-Ergocryptine

cas: 25447-66-9 — see every product listed under this CAS number, including other names

Dihydro-a-Ergocryptine (CAS 25447-66-9) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULE6110
cas25447-66-9
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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categoryChemicals
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Dihydro-alpha-ergocryptine is alpha-Ergocryptine in which a single bond replaces the double bond between positions 9 and 10. It is functionally related to an alpha-ergocryptine. It derives from a hydride of an ergotaman.

Source: ChEBI

Identity
Molecular formulaC32H43N5O5
Molecular weight577.7 g/mol
IUPAC name(6aR,9R,10aR)-N-[(1S,2S,4R,7S)-2-hydroxy-7-(2-methylpropyl)-5,8-dioxo-4-propan-2-yl-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
InChIKeyPBUNVLRHZGSROC-VTIMJTGVSA-N
SMILESCC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C(C)C)NC(=O)[C@@H]4C[C@H]5[C@@H](CC6=CNC7=CC=CC5=C67)N(C4)C)O

Computed by PubChem (NCBI)

Synonyms: Dihydro-alpha-ergocryptine, Dihydroergocryptine, Alpha-Dihydroergocriptine, 9,10-dihydro-alpha-ergocryptine, Dihydroergokryptine Mesylate, Mesylate, Dihydroergocryptine, Mesylate, Dihydroergokryptine, Dihydroergokryptine Monomesylate, Monomesylate, Dihydroergocryptine, Monomesylate, Dihydroergokryptine
Isomers (same molecular formula)
(6aR,9R,10aR)-N-[(1S,2S,4R,7S)-7-[(2S)-butan-2-yl]-2-hydroxy-5,8-dioxo-4-propan-2-yl-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 C32H43N5O5
(6aR,9R,10aR)-N-[(1S,2S,4R,7S)-7-[(2R)-butan-2-yl]-2-hydroxy-5,8-dioxo-4-propan-2-yl-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 C32H43N5O5

Also listed as

Dihydro a-Ergocryptine, >95% (HPLC) TRC CAS 25447-66-9
Dihydroergocryptine Biosynth CAS 25447-66-9