8-Deoxylankolide (CHEBI:204409)

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CHEBI:204409 - 8-Deoxylankolide

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ChEBI ID	CHEBI:204409
ChEBI Name	8-Deoxylankolide
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C23H42O7
Net Charge	0
Average Mass	430.582
Monoisotopic Mass	430.29305
SMILES	CC(O)C(C)[C@@H]1OC(=O)[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)C[C@@H](C)C(=O)[C@@H](C)[C@H](O)[C@H]1C
InChI	InChI=1S/C23H42O7/c1-10-9-11(2)19(26)14(5)21(28)16(7)23(29)30-22(12(3)17(8)24)15(6)20(27)13(4)18(10)25/h10-17,19-22,24,26-28H,9H2,1-8H3/t10-,11+,12?,13-,14+,15-,16-,17?,19+,20+,21-,22+/m1/s1
InChIKey	QXJBHGMYUXAGBM-FPOOCMKLSA-N

Species of Metabolite	Component	Source	Comments
Streptomycesspecies (ncbitaxon:1931)	-	PubMed (9315083)

ChEBI Ontology

Outgoing Relation(s)
	8-Deoxylankolide (CHEBI:204409) is a macrolide (CHEBI:25106)

IUPAC Name
(3R,4R,5S,6S,7S,9R,11S,12R,13R,14S)-4,6,12-trihydroxy-14-(3-hydroxybutan-2-yl)-3,5,7,9,11,13-hexamethyl-oxacyclotetradecane-2,10-dione

Manual Xrefs	Databases
78439681	ChemSpider