cortisol 21-acetate

Chemical Formula:

C₂₃H₃₂O₆

Molecular Weight:

404.502 Daltons

Monoisotopic Mass:

404.21988875979997 Daltons

SMILES:

CC(OCC(C4(CCC3(C2(CCC1(=CC(=O)CCC1(C2C(CC34C)O)C))))O)=O)=O

InChI:

1S/C23H32O6/c1-13(24)29-12-19(27)23(28)9-7-17-16-5-4-14-10-15(25)6-8-21(14,2)20(16)18(26)11-22(17,23)3/h10,16-18,20,26,28H,4-9,11-12H2,1-3H3/t16-,17-,18-,20+,21-,22-,23-/m0/s1

InChIKey:

ALEXXDVDDISNDU-JZYPGELDSA-N

Synonyms

Hydrocortisone acetate

Databases

MetaCyc: CPD-417

LIPID MAPS: LMST02030093

ChemSpider: 5542

PubChem (CID): 5744

ChEBI: 17609

KEGG: C02821

CAS: 50-03-3

RefMet: Cortisol 21-acetate

Seed: cpd01824

MetaNetX: MNXM4531