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CHEBI:172104 - Antibiotic X 14889C

ChEBI IDCHEBI:172104
ChEBI NameAntibiotic X 14889C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H58O10
Net Charge0
Average Mass614.817
Monoisotopic Mass614.40300
SMILESCCC(C(=O)C(C)C(O)C(C)C1OC(O)(CC(=O)O)C(C)CC1C)C1OC(C)(C2(O)OC(CC)(C(C)O)CC2C)CC1C
InChIInChI=1S/C33H58O10/c1-11-24(29-18(4)14-30(10,41-29)33(40)20(6)15-31(12-2,43-33)23(9)34)27(38)21(7)26(37)22(8)28-17(3)13-19(5)32(39,42-28)16-25(35)36/h17-24,26,28-29,34,37,39-40H,11-16H2,1-10H3,(H,35,36)
InChIKeyPMDYHIAMOYUOJS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
Antibiotic X 14889C (CHEBI:172104) is a sesterterpenoid (CHEBI:26660)
IUPAC Name 
2-[6-[6-[5-[5-ethyl-2-hydroxy-5-(1-hydroxyethyl)-3-methyloxolan-2-yl]-3,5-dimethyloxolan-2-yl]-3-hydroxy-4-methyl-5-oxooctan-2-yl]-2-hydroxy-3,5-dimethyloxan-2-yl]acetic acid
Manual XrefsDatabases
35013593ChemSpider
HMDB0033335HMDB