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CHEBI:218814 - Svetamycin E

ChEBI IDCHEBI:218814
ChEBI NameSvetamycin E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H41ClN8O11
Net Charge0
Average Mass677.112
Monoisotopic Mass676.25833
SMILESC[C@H](NC(=O)[C@H]1[C@H](O)[C@H](O)C=NN1C(=O)CO)C(=O)N1NC[C@@H](Cl)C[C@@H]1C(=O)N1NC(C)(C)CC[C@H]1C(=O)N[C@@](C)(CO)C(=O)O
InChIInChI=1S/C26H41ClN8O11/c1-12(30-21(42)18-19(40)16(38)9-29-35(18)17(39)10-36)22(43)33-15(7-13(27)8-28-33)23(44)34-14(5-6-25(2,3)32-34)20(41)31-26(4,11-37)24(45)46/h9,12-16,18-19,28,32,36-38,40H,5-8,10-11H2,1-4H3,(H,30,42)(H,31,41)(H,45,46)/t12-,13-,14-,15+,16+,18+,19+,26-/m0/s1
InChIKeyTZYIGVVFYVFPFJ-IDMDZTOKSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (28489377)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Svetamycin E (CHEBI:218814) is a peptide (CHEBI:16670)
IUPAC Name 
(2S)-2-[[(3S)-2-[(3R,5S)-5-chloro-2-[(2S)-2-[[(3R,4S,5R)-4,5-dihydroxy-2-(2-hydroxyacetyl)-4,5-dihydro-3H-pyridazine-3-carbonyl]amino]propanoyl]diazinane-3-carbonyl]-6,6-dimethyldiazinane-3-carbonyl]amino]-3-hydroxy-2-methylpropanoic acid
Manual XrefsDatabases
78439463ChemSpider