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CHEBI:216038 - Largimycin A2

ChEBI IDCHEBI:216038
ChEBI NameLargimycin A2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H31N3O11S2
Net Charge0
Average Mass649.700
Monoisotopic Mass649.14000
SMILESCC(=O)N[C@H](CS[C@H]1CC(=O)/C=C/C=C\c2coc(n2)/C([C@H]2CO2)=N\OC(=O)C[C@@]2([C@@]3(C(=O)O)CO3)CC[C@]1(C)S2)C(=O)O
InChIInChI=1S/C28H31N3O11S2/c1-15(32)29-18(24(35)36)13-43-20-9-17(33)6-4-3-5-16-11-40-23(30-16)22(19-12-39-19)31-42-21(34)10-27(8-7-26(20,2)44-27)28(14-41-28)25(37)38/h3-6,11,18-20H,7-10,12-14H2,1-2H3,(H,29,32)(H,35,36)(H,37,38)/b5-3-,6-4+,31-22-/t18-,19-,20+,26+,27-,28+/m1/s1
InChIKeyWETQRRWLMLVNIN-UUNPUGERSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (32310633)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Largimycin A2 (CHEBI:216038) is a N-acyl-amino acid (CHEBI:51569)