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:81216 - Chrysanthetriol
Main
ChEBI Ontology
Automatic Xrefs
Reactions
Pathways
Models
ChEBI Name
Chrysanthetriol
ChEBI ID
CHEBI:81216
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
C15H26O3
Net Charge
0
Average Mass
254.36510
Monoisotopic Mass
254.18819
InChI
InChI=1S/C15H26O3/c1-
10-
5-
7-
12(15(3,4)
18)
9-
14(17)
11(2)
6-
8-
13(10)
16/h12-
14,16-
18H,1-
2,5-
9H2,3-
4H3/t12-
,13+,14+/m1/s1
InChIKey
ZJQHXIIOVKOVID-RDBSUJKOSA-N
SMILES
CC(C)(O)[C@@H]1CCC(=C)[C@@H](O)CCC(=C)[C@@H](O)C1
ChEBI Ontology
Outgoing
Chrysanthetriol (
CHEBI:81216
)
is a
germacrane sesquiterpenoid (
CHEBI:68588
)
Manual Xref
Database
C17610
KEGG COMPOUND
View more database links