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COA COO

Dihydro Ergotamine Mesylate Impurity 1

Impurity

CAS Number

81149-12-4

Molecular Formula

C32H37N5O6

Product format

Neat

Molecular Weight

587.68

Storage

-80°C

Shipping

Dry Ice (-80°C)

API Family

Ergotamine

Synonyms

81149-12-4; (5'alpha, 10alpha)-1-Demethyl-9, 10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-2, 3(2H, 3H)-secoergotaman-3, 3', 6', 18-tetrone; (5'a, 10a)-1-Demethyl-9, 10-dihydro-12'-hydroxy-2'-methyl-5'-(phenylmethyl)-2, 3(2H, 3H)-secoergotaman-3, 3', 6' and 18-tetrone

Iupac Name

(2R, 4aR, 10bR)-7-amino-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]-4-methyl-6-oxo-1, 2, 3, 4a, 5 and 10b-hexahydrobenzo[f]quinoline-2-carboxamide

InChI

InChI=1S/C32H37N5O6/c1-31(34-28(39)19-15-21-20-10-6-11-22(33)27(20)25(38)16-23(21)35(2)17-19)30(41)37-24(14-18-8-4-3-5-9-18)29(40)36-13-7-12-26(36)32(37,42)43-31/h3-6,8-11,19,21,23-24,26,42H,7,12-17,33H2,1-2H3,(H,34,39)/t19-,21-,23-,24+,26+,31-,32+/m1/s1

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COA COO

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