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CHEBI:207501 - CLP2

ChEBI IDCHEBI:207501
ChEBI NameCLP2
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC58H103N7O13
Net Charge0
Average Mass1106.498
Monoisotopic Mass1105.76139
SMILESCCCCCCCCCCCCCCC1CC(=O)NC(CCC(=O)OC)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CC(=O)OC)C(=O)NC(CC(C)C)C(=O)NC(C(C)CC)C(=O)O1
InChIInChI=1S/C58H103N7O13/c1-14-16-17-18-19-20-21-22-23-24-25-26-27-41-34-48(66)59-42(28-29-49(67)76-12)52(69)60-43(30-36(3)4)53(70)61-44(31-37(5)6)54(71)62-45(32-38(7)8)55(72)64-47(35-50(68)77-13)56(73)63-46(33-39(9)10)57(74)65-51(40(11)15-2)58(75)78-41/h36-47,51H,14-35H2,1-13H3,(H,59,66)(H,60,69)(H,61,70)(H,62,71)(H,63,73)(H,64,72)(H,65,74)
InChIKeyIHCUBFUKVGBBHR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bacillus (ncbitaxon:1386) - PubMed (28389538)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
CLP2 (CHEBI:207501) is a cyclodepsipeptide (CHEBI:35213)
IUPAC Name 
methyl 3-[3-butan-2-yl-9-(2-methoxy-2-oxoethyl)-6,12,15,18-tetrakis(2-methylpropyl)-2,5,8,11,14,17,20,23-octaoxo-25-tetradecyl-1-oxa-4,7,10,13,16,19,22-heptazacyclopentacos-21-yl]propanoate
Manual XrefsDatabases
64063263ChemSpider