Services
Research
Training
Industry
About us
ChEBI
Examples:
iron*
,
InChI=1S/CH4O/c1-2/h2H,1H3
,
caffeine
Advanced
Home
Advanced Search
Browse
Documentation
Download
Tools
About ChEBI
Submit
Contact us
DiNA
Statistics
Entity of the Month
Periodic Table
Ontology
Train online
User Manual
Annotation Manual
Developer Manual
FAQ's
BiNChE
libChEBI
Web Services
ChEBI
> Main
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
Download
Molfile
XML
SDF
Find compounds which contain this structure
Find compounds which resemble this structure
Take structure to the Advanced Search
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