EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:751889 - estrapronicate

Default Structure
ChEBI IDCHEBI:751889
ChEBI Nameestrapronicate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC27H31NO4
Net Charge0
Average Mass433.548
Monoisotopic Mass433.22531
SMILES[H][C@@]12CCc3cc(OC(=O)CC)ccc3[C@@]1([H])CC[C@]1(C)[C@@H](OC(=O)c3cccnc3)CC[C@@]21[H]
InChIInChI=1S/C27H31NO4/c1-3-25(29)31-19-7-9-20-17(15-19)6-8-22-21(20)12-13-27(2)23(22)10-11-24(27)32-26(30)18-5-4-14-28-16-18/h4-5,7,9,14-16,21-24H,3,6,8,10-13H2,1-2H3/t21-,22-,23+,24+,27+/m1/s1
InChIKeyFXMSQUVSUXBBAB-TXDQRGGKSA-N
ChEBI Ontology
Outgoing Relation(s)
estrapronicate (CHEBI:751889) is a steroid ester (CHEBI:47880)
INNs  Source
estrapronicateWHO MedNet
estrapronicatoWHO MedNet