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CHEBI:214919 - SB 253518

ChEBI IDCHEBI:214919
ChEBI NameSB 253518
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SubmitterMetaboLights
DownloadsMolfile
FormulaC30H48N2O9
Net Charge0
Average Mass580.719
Monoisotopic Mass580.33598
SMILESCCCCCCCCCCC/C=C/[C@@H](CC(=O)NC(=O)/C=C1/OC(=O)N2CCC[C@H]12)O[C@@H]1O[C@@H](C)[C@H](O)[C@@H](O)[C@H]1O
InChIInChI=1S/C30H48N2O9/c1-3-4-5-6-7-8-9-10-11-12-13-15-21(40-29-28(37)27(36)26(35)20(2)39-29)18-24(33)31-25(34)19-23-22-16-14-17-32(22)30(38)41-23/h13,15,19-22,26-29,35-37H,3-12,14,16-18H2,1-2H3,(H,31,33,34)/b15-13+,23-19+/t20-,21-,22+,26-,27+,28+,29-/m0/s1
InChIKeyLVTDKRIMXLJUAE-JTQWKVPKSA-N
Species of MetaboliteComponentSourceComments
Pseudomonas fluorescens (ncbitaxon:294) - PubMed (10994818)
ChEBI Ontology
Outgoing Relation(s)
SB 253518 (CHEBI:214919) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
(E,3R)-N-[(2E)-2-[(7aR)-3-oxo-5,6,7,7a-tetrahydropyrrolo[1,2-c][1,3]oxazol-1-ylidene]acetyl]-3-[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyhexadec-4-enamide
Manual XrefsDatabases
78442781ChemSpider