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CHEBI:221965 - Hapalosin D

ChEBI IDCHEBI:221965
ChEBI NameHapalosin D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC27H41NO6
Net Charge0
Average Mass475.626
Monoisotopic Mass475.29339
SMILESCCCCCCC[C@@H]1CC(=O)O[C@@H](C(C)C)C(=O)N(C)[C@@H](Cc2ccccc2)[C@H](O)CC(=O)O1
InChIInChI=1S/C27H41NO6/c1-5-6-7-8-12-15-21-17-24(30)34-26(19(2)3)27(32)28(4)22(23(29)18-25(31)33-21)16-20-13-10-9-11-14-20/h9-11,13-14,19,21-23,26,29H,5-8,12,15-18H2,1-4H3/t21-,22+,23-,26+/m1/s1
InChIKeyOKLJLJXFMBXPDZ-VUMQFKOGSA-N
Species of MetaboliteComponentSourceComments
Fischerellaspecies PCC 9431 (ncbitaxon:1173023) - PubMed (33599093)
ChEBI Ontology
Outgoing Relation(s)
Hapalosin D (CHEBI:221965) is a lactam (CHEBI:24995)
Hapalosin D (CHEBI:221965) is a macrolide (CHEBI:25106)
IUPAC Name 
(2S,5S,6R,10R)-5-benzyl-10-heptyl-6-hydroxy-4-methyl-2-propan-2-yl-1,9-dioxa-4-azacyclododecane-3,8,12-trione
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23134638ChemSpider