CHEBI:34835 - Methandriol dipropionate

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Methandriol dipropionate
ChEBI ID CHEBI:34835
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C26H40O4
Net Charge 0
Average Mass 416.594
Monoisotopic Mass 416.29266
InChI InChI=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
InChIKey YUKFLTKJFMBYJM-QNSWYLPSSA-N
SMILES CCC(=O)O[C@H]1CC[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](CC[C@]4(C)OC(=O)CC)[C@@H]3CC=C2C1
ChEBI Ontology
Outgoing Methandriol dipropionate (CHEBI:34835) is a steroid ester (CHEBI:47880)
Synonym Source
Methandriol dipropionate KEGG COMPOUND
Manual Xrefs Databases
C14634 KEGG COMPOUND
D08197 KEGG DRUG
View more database links
Registry Number Type Source
3593-85-9 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014