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CHEBI:67572 - (+)-(2S,3S,4R)-10-de-O-carbamoyl-12-O-carbamoyl-Nbeta-acetylstreptothricin F acid

ChEBI IDCHEBI:67572
ChEBI Name(+)-(2S,3S,4R)-10-de-O-carbamoyl-12-O-carbamoyl-Nbeta-acetylstreptothricin F acid
Stars
DefinitionA natural product found in Streptomyces sp. I08A 1776.
Last Modified22 September 2014
DownloadsMolfile
FormulaC21H38N8O10
Net Charge0
Average Mass562.581
Monoisotopic Mass562.27109
SMILES[H][C@]1(C(=O)O)N/C(=N/[C@@H]2O[C@H](COC(N)=O)[C@H](O)[C@@H](O)[C@H]2NC(=O)C[C@H](CCCN)NC(C)=O)N[C@]1([H])[C@H](O)CN
InChIInChI=1S/C21H38N8O10/c1-8(30)25-9(3-2-4-22)5-12(32)26-15-17(34)16(33)11(7-38-20(24)37)39-18(15)29-21-27-13(10(31)6-23)14(28-21)19(35)36/h9-11,13-18,31,33-34H,2-7,22-23H2,1H3,(H2,24,37)(H,25,30)(H,26,32)(H,35,36)(H2,27,28,29)/t9-,10+,11+,13+,14-,15+,16-,17-,18+/m0/s1
InChIKeyLDYDNDBXTDINHR-VSELPKQMSA-N
Species of MetaboliteComponentSourceComments
Streptomyces species I08A 1776 (ncbitaxon:945930) - PubMed (21510638)
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
(+)-(2S,3S,4R)-10-de-O-carbamoyl-12-O-carbamoyl-Nbeta-acetylstreptothricin F acid (CHEBI:67572) has role metabolite (CHEBI:25212)
(+)-(2S,3S,4R)-10-de-O-carbamoyl-12-O-carbamoyl-Nbeta-acetylstreptothricin F acid (CHEBI:67572) is a amino sugar (CHEBI:28963)
Synonym  Source
2-{[(3S)-3-Acetamido-6-aminohexanoyl]amino}-N-{(2E,4S,5S)-5-[(1R)-2-amino-1-hydroxyethyl]-4-carboxy-4,5-dihydro-1H-imidazol-2-yl}-6-O-carbamoyl-2-deoxy-beta-D-gulopyranosylamineChEBI
Citations