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CHEBI:34835 - Methandriol dipropionate

ChEBI IDCHEBI:34835
ChEBI NameMethandriol dipropionate
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC26H40O4
Net Charge0
Average Mass416.602
Monoisotopic Mass416.29266
SMILES[H][C@@]12CC=C3C[C@@H](OC(=O)CC)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])CC[C@]1(C)OC(=O)CC
InChIInChI=1S/C26H40O4/c1-6-22(27)29-18-10-13-24(3)17(16-18)8-9-19-20(24)11-14-25(4)21(19)12-15-26(25,5)30-23(28)7-2/h8,18-21H,6-7,9-16H2,1-5H3/t18-,19+,20-,21-,24-,25-,26-/m0/s1
InChIKeyYUKFLTKJFMBYJM-QNSWYLPSSA-N
ChEBI Ontology
Outgoing Relation(s)
Methandriol dipropionate (CHEBI:34835) is a steroid ester (CHEBI:47880)
Synonym  Source
Methandriol dipropionateKEGG COMPOUND
Manual XrefsDatabases
C14634KEGG COMPOUND
D08197KEGG DRUG
Registry NumbersSources
CAS:3593-85-9KEGG COMPOUND