Produkty 2873-38-3

CAS 2873-38-3 to numer rejestracyjny substancji Ergovaline. Oferty producentów: TRC, Biosynth. Dostępne opakowania: 0,5mg, 1mg, 5mg, 500ug, 250ug, 1000ug.

Ergovaline
TRC, Biosynth
  • opakowanie: 0,5mg, 1mg, 5mg, 500ug
  • Warianty: 6
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Wzór strukturalny: {0} (CAS {1})

(6aR,9R)-N-[(1S,2S,4R,7S)-2-hydroxy-4-methyl-5,8-dioxo-7-propan-2-yl-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 (CAS 2873-38-3) to związek chemiczny o wzorze sumarycznym C29H35N5O5 i masie molowej 533.6 g/mol. Nazwa systematyczna IUPAC: (6aR,9R)-N-[(1S,2S,4R,7S)-2-hydroxy-4-methyl-5,8-dioxo-7-propan-2-yl-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. InChIKey: BGHDUTQZGWOQIA-VQSKNWBGSA-N.

Dane identyfikacyjne
Wzór sumarycznyC29H35N5O5
Masa molowa533.6 g/mol
Nazwa IUPAC(6aR,9R)-N-[(1S,2S,4R,7S)-2-hydroxy-4-methyl-5,8-dioxo-7-propan-2-yl-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
InChIKeyBGHDUTQZGWOQIA-VQSKNWBGSA-N
SMILESCC(C)[C@H]1C(=O)N2CCC[C@H]2[C@]3(N1C(=O)[C@](O3)(C)NC(=O)[C@H]4CN([C@@H]5CC6=CNC7=CC=CC(=C67)C5=C4)C)O

Dane obliczone przez PubChem (NCBI)

Synonimy: Ergovaline, 12'-Hydroxy-2'-methyl-5'alpha-(1-methylethyl)-ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5' alpha-(1-methylethyl)-ergotaman-3',6',18-trione, Ergotaman-3',6',18-trione, 12'-hydroxy-2'-methyl-5'-(1-methylethyl)-, (5'alpha)-, 12'-Hydroxy-2'-methyl-3',6',18-trioxo-5'alpha-(propan-2-yl)ergotaman