CHEBI:222190 - Saccharochelin C

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Saccharochelin C
ChEBI ID CHEBI:222190
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C33H59N7O11
Net Charge 0
Average Mass 729.873
Monoisotopic Mass 729.42726
InChI InChI=1S/C33H59N7O11/c1-2-3-4-5-6-7-8-9-10-11-18-29(44)34-25(15-12-19-38(49)23-42)30(45)37-28(22-41)33(48)40(51)21-14-17-27-32(47)35-26(31(46)36-27)16-13-20-39(50)24-43/h23-28,41,49-51H,2-22H2,1H3,(H,34,44)(H,35,47)(H,36,46)(H,37,45)/t25-,26-,27-,28-/m0/s1
InChIKey RYYQWAOQYVKOPB-LJWNLINESA-N
SMILES O=C1N[C@H](C(=O)N[C@H]1CCCN(O)C(=O)[C@@H](NC(=O)[C@@H](NC(=O)CCCCCCCCCCCC)CCCN(O)C=O)CO)CCCN(O)C=O
Metabolite of Species Details
Saccharothrix (NCBI:txid2071) See: PubMed
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Saccharochelin C (CHEBI:222190) is a dipeptide (CHEBI:46761)
IUPAC Name
N-[(2S)-5-[ormyl(hydroxy)amino]-1-[[(2S)-1-[3-[(2S,5S)-5-[3-[ormyl(hydroxy)amino]propyl]-3,6-dioxopiperazin-2-yl]propyl-hydroxyamino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxopentan-2-yl]tridecanamide