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CHEBI:210191 - Albogrisin B

ChEBI IDCHEBI:210191
ChEBI NameAlbogrisin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H32N4O7
Net Charge0
Average Mass500.552
Monoisotopic Mass500.22710
SMILESCO[C@H](C(=O)c1ccccc1N)[C@@H]1C(=O)N(C)C=C(C(=O)N[C@@H](CCC(=O)O)C(=O)C=C(C)C)N1C
InChIInChI=1S/C25H32N4O7/c1-14(2)12-19(30)17(10-11-20(31)32)27-24(34)18-13-28(3)25(35)21(29(18)4)23(36-5)22(33)15-8-6-7-9-16(15)26/h6-9,12-13,17,21,23H,10-11,26H2,1-5H3,(H,27,34)(H,31,32)/t17-,21+,23-/m0/s1
InChIKeyGQBGVQRFWDUSTB-LXBDKUERSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (31613107)
ChEBI Ontology
Outgoing Relation(s)
Albogrisin B (CHEBI:210191) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
(4S)-4-[[(2R)-2-[(1S)-2-(2-aminophenyl)-1-methoxy-2-oxoethyl]-1,4-dimethyl-3-oxo-2H-pyrazine-6-carbonyl]amino]-7-methyl-5-oxooct-6-enoic acid
Manual XrefsDatabases
78315751ChemSpider