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CHEBI:220167 - Variochelin B

ChEBI IDCHEBI:220167
ChEBI NameVariochelin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC49H87N11O17
Net Charge0
Average Mass1102.295
Monoisotopic Mass1101.62814
SMILESCCCCCCCCCCCCCC(=O)N[C@@H](CCCN=C(N)N)[C@@H](O)[C@H](C)C(=O)N[C@H](C(=O)N[C@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCN(O)C(C)=O)C(=O)N[C@@H](CCCN(O)C(C)=O)C(=O)O)[C@H](O)C(=O)O
InChIInChI=1S/C49H87N11O17/c1-5-6-7-8-9-10-11-12-13-14-15-24-38(64)53-33(20-16-25-52-49(50)51)40(65)30(2)42(67)57-39(41(66)48(74)75)45(70)56-36(29-61)46(71)58-26-19-23-37(58)44(69)54-34(21-17-27-59(76)31(3)62)43(68)55-35(47(72)73)22-18-28-60(77)32(4)63/h30,33-37,39-41,61,65-66,76-77H,5-29H2,1-4H3,(H,53,64)(H,54,69)(H,55,68)(H,56,70)(H,57,67)(H,72,73)(H,74,75)(H4,50,51,52)/t30-,33-,34-,35-,36+,37-,39-,40-,41-/m0/s1
InChIKeyKAFRRCNQGFIZFI-WKKVWVOWSA-N
Species of MetaboliteComponentSourceComments
Variovorax boronicumulans (ncbitaxon:436515) - PubMed (27023373)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Variochelin B (CHEBI:220167) is a polypeptide (CHEBI:15841)