Nombre del analito

11-Hydroxy-2'-methyl-3,20-dioxo-5'H-Pregna-1,4-dieno[17,16-d]oxazol-21-al

Número CAS

3035569-86-6

Fórmula molecular

C23H27NO5

Peso molecular

397.46418

Masa exacta

397.1889

SMILES

CC1=N[C@@]2([C@@H](C[C@H]3[C@@H]4CCC5=CC(=O)C=C[C@]5(C)[C@H]4[C@@H](O)C[C@]23C)O1)C(=O)C=O

InChI

InChI=1S/C23H27NO5/c1-12-24-23(18(28)11-25)19(29-12)9-16-15-5-4-13-8-14(26)6-7-21(13,2)20(15)17(27)10-22(16,23)3/h6-8,11,15-17,19-20,27H,4-5,9-10H2,1-3H3/t15-,16-,17-,19+,20+,21-,22-,23+/m0/s1

IUPAC

2-[(1S,2S,4R,8S,9S,11S,12S,13R)-11-hydroxy-6,9,13-trimethyl-16-oxo-5-oxa-7-azapentacyclo[10.8.0.02,9.04,8.013,18]icosa-6,14,17-trien-8-yl]-2-oxo-acetaldehyde

País de origen

CANADA

Formato del producto

Neat