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CHEBI:208572 - (2E,4S,6S,10S,13R,14S,15S)-4,10-dihydroxy-3,11,11,13,15-pentamethyl-6-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-7,17-dioxabicyclo[12.2.1]heptadec-2-ene-8,12-dione

ChEBI IDCHEBI:208572
ChEBI Name(2E,4S,6S,10S,13R,14S,15S)-4,10-dihydroxy-3,11,11,13,15-pentamethyl-6-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-7,17-dioxabicyclo[12.2.1]heptadec-2-ene-8,12-dione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H39NO6S
Net Charge0
Average Mass505.677
Monoisotopic Mass505.24981
SMILESC/C(=C\c1csc(C)n1)[C@@H]1C[C@H](O)/C(C)=C/C2C[C@H](C)[C@H](O2)[C@@H](C)C(=O)C(C)(C)[C@@H](O)CC(=O)O1
InChIInChI=1S/C27H39NO6S/c1-14-9-20-10-16(3)25(33-20)17(4)26(32)27(6,7)23(30)12-24(31)34-22(11-21(14)29)15(2)8-19-13-35-18(5)28-19/h8-9,13,16-17,20-23,25,29-30H,10-12H2,1-7H3/b14-9+,15-8+/t16-,17+,20?,21-,22-,23-,25-/m0/s1
InChIKeyYKZVLNGSDRIEMD-UKQRZVQDSA-N
Species of MetaboliteComponentSourceComments
Myxococcus (ncbitaxon:32) - PubMed (14575429)
ChEBI Ontology
Outgoing Relation(s)
(2E,4S,6S,10S,13R,14S,15S)-4,10-dihydroxy-3,11,11,13,15-pentamethyl-6-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-7,17-dioxabicyclo[12.2.1]heptadec-2-ene-8,12-dione (CHEBI:208572) is a macrolide (CHEBI:25106)
IUPAC Name 
(2E,4S,6S,10S,13R,14S,15S)-4,10-dihydroxy-3,11,11,13,15-pentamethyl-6-[(E)-1-(2-methyl-1,3-thiazol-4-yl)prop-1-en-2-yl]-7,17-dioxabicyclo[12.2.1]heptadec-2-ene-8,12-dione
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10208132ChemSpider