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CHEBI:218705 - Platensimycin A6

ChEBI IDCHEBI:218705
ChEBI NamePlatensimycin A6
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SubmitterMetaboLights
DownloadsMolfile
FormulaC24H29NO8
Net Charge0
Average Mass459.495
Monoisotopic Mass459.18932
SMILESC[C@]12C[C@]34CC1C[C@H](O2)C3[C@](C)(CCC(=O)Nc1c(O)ccc(C(=O)O)c1O)C(=O)C[C@H]4O
InChIInChI=1S/C24H29NO8/c1-22(6-5-17(29)25-18-13(26)4-3-12(19(18)30)21(31)32)15(27)8-16(28)24-9-11-7-14(20(22)24)33-23(11,2)10-24/h3-4,11,14,16,20,26,28,30H,5-10H2,1-2H3,(H,25,29)(H,31,32)/t11?,14-,16+,20?,22+,23-,24-/m0/s1
InChIKeyCXJWEANXZBYQKF-XPEDPDGJSA-N
Species of MetaboliteComponentSourceComments
Streptomyces platensis (ncbitaxon:58346) - PubMed (21214253)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Platensimycin A6 (CHEBI:218705) is a amidobenzoic acid (CHEBI:48470)
IUPAC Name 
2,4-dihydroxy-3-[3-[(1R,2R,5S,7S,9S)-2-hydroxy-5,9-dimethyl-4-oxo-8-oxatetracyclo[7.2.1.17,10.01,6]tridecan-5-yl]propanoylamino]benzoic acid