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COA COO

Ergosine

Impurity

CAS Number

561-94-4

Molecular Formula

C30H37N5O5

Product format

Neat

Molecular Weight

547.66

Shipping

Room Temperature

API Family

Ergotamine

Synonyms

Ergosine; 561-94-4; alpha-Ergosine; 6WF908487H; CHEBI:4823; DTXSID50893989; NSC-122047; (6aR, 9R)-N-[(1S, 2S, 4R, 7S)-2-hydroxy-4-methyl-7-(2-methylpropyl)-5, 8-dioxo-3-oxa-6, 9-diazatricyclo[7.3.0.02, 6]dodecan-4-yl]-7-methyl-6, 6a, 8, 9-tetrahydro-4H-indolo[4, 3-fg]quinoline-9-carboxamide; (5'alpha)-12'-hydroxy-2'-methyl-5'-(2-methylpropyl)-3', 6', 18-trioxoergotaman; 12'-hydroxy-2'-methyl-5' alpha-(2-methylpropyl)-8 alpha-ergotaman-3', 6', 18-trione; (6aR, 9R)-N-((1S, 2S, 4R, 7S)-2-hydroxy-4-methyl-7-(2-methylpropyl)-5, 8-dioxo-3-oxa-6, 9-diazatricyclo(7.3.0.02, 6)dodecan-4-yl)-7-methyl-6, 6a, 8, 9-tetrahydro-4H-indolo(4, 3-fg)quinoline-9-carboxamide; RefChem:137523; DTXCID101324032; 209-226-6; (5'alpha)-12'-hydroxy-5'-isobutyl-2'-methyl-3', 6', 18-trioxoergotaman; (5'alpha)-12'-hydroxy-2'-methyl-5'-(2-methylpropyl)ergotaman-3', 6' and 18-trione; EINECS 209-226-6; NSC 122047; BRN 0102152; ergosin

Iupac Name

(6aR, 9R)-N-[(1S, 2S, 4R, 7S)-2-hydroxy-4-methyl-7-(2-methylpropyl)-5, 8-dioxo-3-oxa-6, 9-diazatricyclo[7.3.0.02, 6]dodecan-4-yl]-7-methyl-6, 6a, 8, 9-tetrahydro-4H-indolo[4 and 3-fg]quinoline-9-carboxamide

InChI

InChI=1S/C30H37N5O5/c1-16(2)11-23-27(37)34-10-6-9-24(34)30(39)35(23)28(38)29(3,40-30)32-26(36)18-12-20-19-7-5-8-21-25(19)17(14-31-21)13-22(20)33(4)15-18/h5,7-8,12,14,16,18,22-24,31,39H,6,9-11,13,15H2,1-4H3,(H,32,36)/t18-,22-,23+,24+,29-,30+/m1/s1

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COA COO

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