CHEBI:216276 - TM-126

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name TM-126
ChEBI ID CHEBI:216276
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H30O4
Net Charge 0
Average Mass 358.478
Monoisotopic Mass 358.21441
InChI InChI=1S/C22H30O4/c1-6-8-9-11-15(3)12-10-13-16(4)21(24)17(5)20-14-19(23)18(7-2)22(25)26-20/h6,8-10,12-14,16-17,21,23-24H,1,7,11H2,2-5H3/b9-8+,13-10+,15-12-/t16-,17+,21+/m0/s1
InChIKey OYGZQEYDCNZTEN-LYALJFTLSA-N
SMILES O=C1OC(=CC(=C1CC)O)[C@H]([C@H](O)[C@H](/C=C/C=C(\C/C=C/C=C)/C)C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing TM-126 (CHEBI:216276) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name
3-ethyl-4-hydroxy-6-[(2S,3R,4S,5E,7Z,10E)-3-hydroxy-4,8-dimethyltrideca-5,7,10,12-tetraen-2-yl]pyran-2-one