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CHEBI:221563 - Halymecin D

ChEBI IDCHEBI:221563
ChEBI NameHalymecin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H74O15
Net Charge0
Average Mass795.017
Monoisotopic Mass794.50277
SMILESCCCCC[C@H](O)C[C@@H](O)CC(=O)O[C@H](CCCC(C)O)C[C@@H](O)CC(=O)O[C@H](CCCCC)C[C@@H](O)CC(=O)O[C@H](CCCC(C)O)C[C@@H](O)CC(=O)O
InChIInChI=1S/C40H74O15/c1-5-7-9-15-29(43)19-30(44)24-38(50)55-36(18-12-14-28(4)42)22-33(47)26-39(51)53-34(16-10-8-6-2)21-32(46)25-40(52)54-35(17-11-13-27(3)41)20-31(45)23-37(48)49/h27-36,41-47H,5-26H2,1-4H3,(H,48,49)/t27?,28?,29-,30+,31+,32+,33+,34+,35+,36+/m0/s1
InChIKeyDINLGKBBYJNJHA-PWMHDYCUSA-N
Species of MetaboliteComponentSourceComments
Acremonium (ncbitaxon:159075) - PubMed (8968393)
ChEBI Ontology
Outgoing Relation(s)
Halymecin D (CHEBI:221563) has functional parent tetracarboxylic acid (CHEBI:35742)
Halymecin D (CHEBI:221563) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(3R,5R)-5-[(3R,5R)-5-[(3R,5R)-5-[(3R,5S)-3,5-dihydroxydecanoyl]oxy-3,9-dihydroxydecanoyl]oxy-3-hydroxydecanoyl]oxy-3,9-dihydroxydecanoic acid