CHEBI:2829 - Arnicolide A

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Arnicolide A
ChEBI ID CHEBI:2829
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C17H22O5
Net Charge 0
Average Mass 306.354
Monoisotopic Mass 306.14672
InChI InChI=1S/C17H22O5/c1-8-7-12-14(9(2)16(20)22-12)15(21-10(3)18)17(4)11(8)5-6-13(17)19/h5-6,8-9,11-12,14-15H,7H2,1-4H3/t8-,9+,11+,12-,14-,15+,17+/m1/s1
InChIKey NEIIKBWBBCJSQU-HESYKRBGSA-N
SMILES C[C@H]1[C@@H]2[C@@H](C[C@@H](C)[C@@H]3C=CC(=O)[C@@]3(C)[C@H]2OC(C)=O)OC1=O
ChEBI Ontology
Outgoing Arnicolide A (CHEBI:2829) is a sesquiterpene lactone (CHEBI:37667)
Synonyms Sources
Arnicolide A KEGG COMPOUND
Dihydrohelenalin acatate KEGG COMPOUND
Manual Xrefs Databases
C00003217 KNApSAcK
C09299 KEGG COMPOUND
View more database links
Registry Number Type Source
36505-53-0 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014