CHEBI:221522 - AKML B

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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 AKML B
ChEBI ID CHEBI:221522
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C24H40O6
Net Charge 0
Average Mass 424.578
Monoisotopic Mass 424.28249
InChI InChI=1S/C24H40O6/c1-18-14-11-9-7-5-3-2-4-6-8-10-12-15-19(25)22(28)24-23(30-24)20(26)16-13-17-21(27)29-18/h5,7,13,17-20,22-26,28H,2-4,6,8-12,14-16H2,1H3/b7-5+,17-13+/t18-,19-,20+,22+,23+,24-/m1/s1
InChIKey IPQFTLZJZZJBFU-DSTYBVLBSA-N
SMILES O=C1O[C@@H](CCCC=CCCCCCCCC[C@H]([C@@H]([C@@H]2[C@H]([C@H](CC=C1)O)O2)O)O)C
Metabolite of Species Details
Aspergillus luchuensis (NCBI:txid1069201) See: PubMed
ChEBI Ontology
Outgoing AKML B (CHEBI:221522) is a carboxylic ester (CHEBI:33308)