(8S)-2-Bromo-alpha-Ergocryptine

CAS: 65700-36-9

Ref. TR-B682605

Product Information

• Name: (8S)-2-Bromo-alpha-Ergocryptine
• Synonyms: Ergotaman-3',6',18-trione, 2-bromo-12'-hydroxy-2'-(1-methylethyl)-5'-(2-methylpropyl)-, (5'a,8a)- (9CI), 8H-Oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine, ergotaman-3',6',18-trione deriv., Indolo[4,3-fg]quinoline, ergotaman-3',6',18-trione deriv., 2-Bromo-a-ergocr, 8H-Oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine,ergotaman-3',6',18-trione deriv., Indolo[4,3-fg]quinoline,ergotaman-3',6',18-trione deriv., 2-Bromo-a-ergocryptinine, 2-Bromo-a-ergokryptinin, 8-Epibromocriptine, 8-Isobromocriptine, Isobromocriptine
• CAS: 65700-36-9

Description

Applications The (8S)-epimer of 2-Bromo-α-Ergocryptine (B682600), as impurity. Dopamine receptor agonist; derivative of the ergotoxin group of ergot alkaloids. Prolactin inhibitor; antiparkinsonian.
References Giron-Forest,D.A., et al.: Anal. Profiles Drug Subs., 8, 47 (1979), Camerman, N., et al.: Mol. Pharmacol., 19, 517 (1981), Ho, K.Y., et al.: Drugs, 36, 67 (1988),

• Brand: TRC

Chemical properties

• Molecular weight: 654.595
• Formula: C₃₂H₄₀BrN₅O₅
• Color/Form: Neat
• InChI: InChI=1S/C32H40BrN5O5/c1-16(2)12-24-29(40)37-11-7-10-25(37)32(42)38(24)30(41)31(43-32,17(3)4)35-28(39)18-13-20-19-8-6-9-22-26(19)21(27(33)34-22)14-23(20)36(5)15-18/h6,8-9,13,16-18,23-25,34,42H,7,10-12,14-15H2,1-5H3,(H,35,39)/t18-,23+,24-,25-,31+,32-/m0/s1
• InChI key: InChIKey=OZVBMTJYIDMWIL-SHUSXKRSSA-N
• SMILES: CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@H]3C=C4c5cccc6[nH]c(Br)c(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12