Nicocortonide

Molecular Formula: C₃₁H₃₇NO₇

InChI: InChI=1/C31H37NO7/c1-4-5-25-38-30-12-13-31(39-25,24(35)18-37-27(36)19-9-14-32-15-10-19)29(30,3)17-23(34)26-22(30)7-6-20-16-21(33)8-11-28(20,26)2/h4-5,9-10,14-16,22-23,25-26,34H,6-8,11-13,17-18H2,1-3H3/t22-,23+,25u,26-,28+,29+,30-,31+/m1/s1

InChIKey: InChIKey=LZHLAFIPUJPCBN-UDADJSBUBY
SMILES: CC=CC1OC23CCC(C2(CC(C4C3CCC5=CC(=O)CCC45C)O)C)(O1)C(=O)COC(=O)C6=CC=NC=C6

Names:
    EINECS 265-754-7
    Nicocortonida [INN-Spanish]
    Nicocortonide [INN]
    Nicocortonide
    Nicocortonidum [INN-Latin]
    Pregn-4-ene-3,20-dione, 14,17-(2-butenylidenebis(oxy))-11-hydroxy-21-((4-pyridinylcarbonyl)oxy)-, (11beta)-
    11beta,14,17,21-Tetrahydroxypregn-4-ene-3,20-dione cyclic 14,17-acetal with crotonaldehyde, 21-isonicotinate
    11beta,21-Dihydroxy-14alpha,17alpha-(1-propenylmethylendioxy)-4-pregnen-3,20-dion 21-isonicotinat
    65415-41-0

Registries:
    PubChem CID 6436148
    PubChem ID 214023