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CHEBI:216032 - Largimycin A1

ChEBI IDCHEBI:216032
ChEBI NameLargimycin A1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC33H40N4O14S3
Net Charge0
Average Mass812.898
Monoisotopic Mass812.17031
SMILESCC(=O)N[C@H](CSC[C@@H](O)/C1=N/OC(=O)C[C@@]2([C@@]3(C(=O)O)CO3)CC[C@@](C)(SC[C@@H](NC(C)=O)C(=O)O)[C@H](CC(=O)/C=C/C=C\c3coc1n3)S2)C(=O)O
InChIInChI=1S/C33H40N4O14S3/c1-17(38)34-21(28(43)44)13-52-15-23(41)26-27-36-19(12-49-27)6-4-5-7-20(40)10-24-31(3,53-14-22(29(45)46)35-18(2)39)8-9-32(54-24,11-25(42)51-37-26)33(16-50-33)30(47)48/h4-7,12,21-24,41H,8-11,13-16H2,1-3H3,(H,34,38)(H,35,39)(H,43,44)(H,45,46)(H,47,48)/b6-4-,7-5+,37-26-/t21-,22-,23-,24+,31-,32-,33+/m1/s1
InChIKeyMFQKLNRDQFKCIX-IFENHQAWSA-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 A1 (CHEBI:216032) is a N-acyl-amino acid (CHEBI:51569)