EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:206189 - Plantazolicin

ChEBI IDCHEBI:206189
ChEBI NamePlantazolicin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC63H69N17O13S2
Net Charge0
Average Mass1336.485
Monoisotopic Mass1335.47022
SMILESCC[C@H](C)[C@H](NC(=O)c1nc(-c2nc(-c3csc(-c4nc(-c5csc(C(CCCN=C(N)N)N(C)C)n5)oc4C)n3)oc2C)oc1C)C(=O)N[C@H](c1nc(-c2nc(-c3nc(-c4nc(C5=NC(C(=O)N[C@@H](Cc6ccccc6)C(=O)O)C(C)O5)co4)co3)co2)co1)[C@@H](C)CC
InChIInChI=1S/C63H69N17O13S2/c1-11-28(3)43(74-51(83)46-31(6)93-59(77-46)47-32(7)91-56(78-47)41-27-95-61(73-41)48-33(8)92-57(79-48)40-26-94-60(72-40)42(80(9)10)19-16-20-66-63(64)65)49(81)75-44(29(4)12-2)58-71-38(24-89-58)54-69-36(22-87-54)52-68-37(23-86-52)53-70-39(25-88-53)55-76-45(30(5)90-55)50(82)67-35(62(84)85)21-34-17-14-13-15-18-34/h13-15,17-18,22-30,35,42-45H,11-12,16,19-21H2,1-10H3,(H,67,82)(H,74,83)(H,75,81)(H,84,85)(H4,64,65,66)/t28-,29-,30?,35-,42?,43-,44-,45?/m0/s1
InChIKeySKALCVOFYPVXLA-DUJKJIRYSA-N
Species of MetaboliteComponentSourceComments
Bacillus velezensis FZB42 (ncbitaxon:326423) - PubMed (21950656)
ChEBI Ontology
Outgoing Relation(s)
Plantazolicin (CHEBI:206189) is a phenylalanine derivative (CHEBI:25985)
IUPAC Name 
(2S)-2-[[2-[2-[2-[2-[2-[(1S,2S)-1-[[(2S,3S)-2-[[2-[2-[2-[2-[2-[4-(diaminomethylideneamino)-1-(dimethylamino)butyl]-1,3-thiazol-4-yl]-5-methyl-1,3-oxazol-4-yl]-1,3-thiazol-4-yl]-5-methyl-1,3-oxazol-4-yl]-5-methyl-1,3-oxazole-4-carbonyl]amino]-3-methylpentanoyl]amino]-2-methylbutyl]-1,3-oxazol-4-yl]-1,3-oxazol-4-yl]-1,3-oxazol-4-yl]-1,3-oxazol-4-yl]-5-methyl-4,5-dihydro-1,3-oxazole-4-carbonyl]amino]-3-phenylpropanoic acid
Manual XrefsDatabases
78445675ChemSpider