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Structure

(8S)-2-Bromo α-ergocryptine

CAS
65700-36-9
Catalog Number
ACM65700369
Category
Other Products
Molecular Weight
654.59
Molecular Formula
C32H40BrN5O5

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Specification

Synonyms
(5'α,8α)-2-Bromo-12'-hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)ergotaman-3',6',18-trione; 2-Bromo-α-ergocryptinine; 2-Bromo-α-ergokryptinin; 8-Epibromocriptine; 8-Isobromocriptine; Isobromocriptine;
IUPAC Name
(5 inverted exclamation mark |A,8|A)-2-Bromo-12-hydroxy-2-(1-methyle...
Canonical SMILES
CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O
InChI Key
OZVBMTJYIDMWIL-SHUSXKRSSA-N
Exact Mass
653.22100
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