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CHEBI:750519 - cinoxolone

Default Structure
ChEBI IDCHEBI:750519
ChEBI Namecinoxolone
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC41H56O5
Net Charge0
Average Mass628.894
Monoisotopic Mass628.41277
SMILES[H][C@]12C(=O)C=C3[C@]4([H])C[C@@](C)(C(=O)OC/C=C/c5ccccc5)CC[C@]4(C)CC[C@@]3(C)[C@]1(C)CC[C@@]1([H])C(C)(C)[C@@H](OC(C)=O)CC[C@]21C
InChIInChI=1S/C41H56O5/c1-27(42)46-33-17-18-39(6)32(36(33,2)3)16-19-41(8)34(39)31(43)25-29-30-26-38(5,21-20-37(30,4)22-23-40(29,41)7)35(44)45-24-12-15-28-13-10-9-11-14-28/h9-15,25,30,32-34H,16-24,26H2,1-8H3/b15-12+/t30-,32-,33-,34+,37+,38-,39-,40+,41+/m0/s1
InChIKeyQTPSNPBHOMYPHQ-NKXVUIFGSA-N
ChEBI Ontology
Outgoing Relation(s)
cinoxolone (CHEBI:750519) is a triterpenoid (CHEBI:36615)
INNs  Source
cinoxolonaWHO MedNet
cinoxoloneWHO MedNet
Synonyms  Source
BX 311ChEMBL
BX-311ChEMBL