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CHEBI:206362 - Bananamide D

ChEBI IDCHEBI:206362
ChEBI NameBananamide D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC53H92N8O14
Net Charge0
Average Mass1065.361
Monoisotopic Mass1064.67330
SMILESCCCCCCC/C=C\C(O)CC(=O)NC(CC(C)C)C(=O)NC(CC(=O)O)C(=O)NC1C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CO)C(=O)NC(CC(C)C)C(=O)NC(C(C)CC)C(=O)OC1C
InChIInChI=1S/C53H92N8O14/c1-13-15-16-17-18-19-20-21-35(63)26-42(64)54-36(22-29(3)4)46(67)57-40(27-43(65)66)50(71)61-45-34(12)75-53(74)44(33(11)14-2)60-49(70)39(25-32(9)10)56-51(72)41(28-62)59-48(69)37(23-30(5)6)55-47(68)38(24-31(7)8)58-52(45)73/h20-21,29-41,44-45,62-63H,13-19,22-28H2,1-12H3,(H,54,64)(H,55,68)(H,56,72)(H,57,67)(H,58,73)(H,59,69)(H,60,70)(H,61,71)(H,65,66)/b21-20-
InChIKeyFHYXCMJTACIUBG-MRCUWXFGSA-N
Species of MetaboliteComponentSourceComments
Pseudomonas botevensis (ncbitaxon:2842352) - PubMed (31744250)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Bananamide D (CHEBI:206362) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
4-[[3-butan-2-yl-9-(hydroxymethyl)-19-methyl-6,12,15-tris(2-methylpropyl)-2,5,8,11,14,17-hexaoxo-1-oxa-4,7,10,13,16-pentazacyclononadec-18-yl]amino]-3-[[2-[[(Z)-3-hydroxydodec-4-enoyl]amino]-4-methylpentanoyl]amino]-4-oxobutanoic acid