Analyte Name

N-Desmethyl N-Acetyl Ulipristal Acetate

CAS Number

244206-56-2

Molecular Formula

C31H37NO5

Molecular Weight

503.64

Accurate Mass

503.27

SMILES

C[C@@]12[C@@](OC(C)=O)(C(C)=O)CC[C@]1([C@]3(C([C@H](C2)C4=CC=C(N(C(C)=O)C)C=C4)=C5C(CC3)=CC(=O)CC5)[H])[H]

InChI

InChI=1S/C31H37NO5/c1-18(33)31(37-20(3)35)15-14-28-26-12-8-22-16-24(36)11-13-25(22)29(26)27(17-30(28,31)4)21-6-9-23(10-7-21)32(5)19(2)34/h6-7,9-10,16,26-28H,8,11-15,17H2,1-5H3/t26-,27+,28-,30-,31-/m0/s1

IUPAC

(8S,11R,13S,14S,17R)-17-acetyl-13-methyl-11-(4-(N-methylacetamido)phenyl)-3-oxo-2,3,6,7,8,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl acetate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

API

Product Format

Neat