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CHEBI:202420 - WA8242A1

ChEBI IDCHEBI:202420
ChEBI NameWA8242A1
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SubmitterMetaboLights
DownloadsMolfile
FormulaC39H74N2O7
Net Charge0
Average Mass683.028
Monoisotopic Mass682.54960
SMILESCC(C)CCCCCCCCCCC[C@H](O)CC(=O)N[C@@H](CCCC(=O)O)C(=O)O[C@@H](CCCCCCCCCCC(C)C)CC(N)=O
InChIInChI=1S/C39H74N2O7/c1-31(2)23-18-14-10-6-5-7-12-16-20-25-33(42)29-37(44)41-35(27-22-28-38(45)46)39(47)48-34(30-36(40)43)26-21-17-13-9-8-11-15-19-24-32(3)4/h31-35,42H,5-30H2,1-4H3,(H2,40,43)(H,41,44)(H,45,46)/t33-,34-,35-/m0/s1
InChIKeyBSNMYXPQSLGSDY-IMKBVMFZSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (9531980)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
WA8242A1 (CHEBI:202420) is a depsipeptide (CHEBI:23643)
IUPAC Name 
(5S)-6-[(3S)-1-amino-14-methyl-1-oxopentadecan-3-yl]oxy-5-[[(3S)-3-hydroxy-15-methylhexadecanoyl]amino]-6-oxohexanoic acid
Manual XrefsDatabases
8137145ChemSpider