EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:203847 - Haplofungin D

ChEBI IDCHEBI:203847
ChEBI NameHaplofungin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H56O9
Net Charge0
Average Mass572.780
Monoisotopic Mass572.39243
SMILESCCCCCCCCCC(O)CCCCC(C)CC(C)/C=C(\C)C(=O)C(C)C(=O)OC(CO)C(O)C(O)C(=O)O
InChIInChI=1S/C31H56O9/c1-6-7-8-9-10-11-12-16-25(33)17-14-13-15-21(2)18-22(3)19-23(4)27(34)24(5)31(39)40-26(20-32)28(35)29(36)30(37)38/h19,21-22,24-26,28-29,32-33,35-36H,6-18,20H2,1-5H3,(H,37,38)/b23-19+
InChIKeyUUQBKUDQQXPGGI-FCDQGJHFSA-N
Species of MetaboliteComponentSourceComments
Lauriomyces (ncbitaxon:651707) - PubMed (19644518)
ChEBI Ontology
Outgoing Relation(s)
Haplofungin D (CHEBI:203847) is a long-chain fatty alcohol (CHEBI:17135)
IUPAC Name 
2,3,5-trihydroxy-4-[(E)-13-hydroxy-2,4,6,8-tetramethyl-3-oxodocos-4-enoyl]oxypentanoic acid
Manual XrefsDatabases
8048583ChemSpider