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CHEBI:222231 - Bonnevillamide D

ChEBI IDCHEBI:222231
ChEBI NameBonnevillamide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC44H64Cl2N6O14
Net Charge0
Average Mass971.930
Monoisotopic Mass970.38576
SMILESCO/C(=C\c1cc(Cl)c(O)c(Cl)c1)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)N1[C@H](C)[C@@H](OC(C)=O)C[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N(O)[C@H](C(=O)N1[C@@H](C)C[C@H]1C(=O)O)C(C)C)[C@@H](C)O
InChIInChI=1S/C44H64Cl2N6O14/c1-19(2)12-29(48-40(58)35(24(9)53)49-39(57)34(65-11)17-26-15-27(45)37(55)28(46)16-26)41(59)51-23(8)33(66-25(10)54)18-31(51)38(56)47-30(13-20(3)4)42(60)52(64)36(21(5)6)43(61)50-22(7)14-32(50)44(62)63/h15-17,19-24,29-33,35-36,53,55,64H,12-14,18H2,1-11H3,(H,47,56)(H,48,58)(H,49,57)(H,62,63)/b34-17-/t22-,23+,24+,29-,30-,31-,32-,33-,35-,36-/m0/s1
InChIKeyLMBVXCIECVQZON-HYJPTLHKSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (33979513)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Bonnevillamide D (CHEBI:222231) is a oligopeptide (CHEBI:25676)