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CHEBI:79852 - Estra-1,3,5(10)-triene-3,16alpha-diol dipropionate

ChEBI IDCHEBI:79852
ChEBI NameEstra-1,3,5(10)-triene-3,16alpha-diol dipropionate
Stars
DownloadsMolfile
FormulaC24H32O4
Net Charge0
Average Mass384.516
Monoisotopic Mass384.23006
SMILES[H][C@@]12CCc3cc(OC(=O)CC)ccc3[C@@]1([H])CC[C@]1(C)C[C@H](OC(=O)CC)C[C@]12[H]
InChIInChI=1S/C24H32O4/c1-4-22(25)27-16-7-9-18-15(12-16)6-8-20-19(18)10-11-24(3)14-17(13-21(20)24)28-23(26)5-2/h7,9,12,17,19-21H,4-6,8,10-11,13-14H2,1-3H3/t17-,19-,20-,21+,24-/m1/s1
InChIKeySPPGAQTVRFMVLJ-ISPHGWFKSA-N
ChEBI Ontology
Outgoing Relation(s)
Estra-1,3,5(10)-triene-3,16alpha-diol dipropionate (CHEBI:79852) is a steroid ester (CHEBI:47880)
Manual XrefsDatabases
C15350KEGG COMPOUND