Nombre del analito

beta-Ergocryptinine-d3

Fórmula molecular

C32 D3 H38 N5 O5

Peso molecular

578.717

Masa exacta

578.33

SMILES

[2H]C([2H])([2H])N1C[C@H](C=C2[C@H]1Cc3c[nH]c4cccc2c34)C(=O)N[C@]5(O[C@@]6(O)[C@@H]7CCCN7C(=O)[C@@H]([C@@H](C)CC)N6C5=O)C(C)C

InChI

InChI=1S/C32H41N5O5/c1-6-18(4)27-29(39)36-12-8-11-25(36)32(41)37(27)30(40)31(42-32,17(2)3)34-28(38)20-13-22-21-9-7-10-23-26(21)19(15-33-23)14-24(22)35(5)16-20/h7,9-10,13,15,17-18,20,24-25,27,33,41H,6,8,11-12,14,16H2,1-5H3,(H,34,38)/t18-,20-,24+,25-,27+,31-,32-/m0/s1/i5D3

IUPAC

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

Tipo SIL

Deuterium

Temperatura de envío

Room Temperature

País de origen

CANADA

Formato del producto

Neat