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CHEBI:221546 - CIML D

ChEBI IDCHEBI:221546
ChEBI NameCIML D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H51NO8P
Net Charge+1
Average Mass548.678
Monoisotopic Mass548.33468
SMILESC[C@@H]1CCCCCCCCCCCC[C@H](O)[C@H]2O[C@@H]2[C@@H](OP(=O)(O)OCC[N+](C)(C)C)C=CC=C(O)O1
InChIInChI=1S/C27H50NO8P/c1-22-16-13-11-9-7-5-6-8-10-12-14-17-23(29)26-27(35-26)24(18-15-19-25(30)34-22)36-37(31,32)33-21-20-28(2,3)4/h15,18-19,22-24,26-27,29H,5-14,16-17,20-21H2,1-4H3,(H-,30,31,32)/p+1/t22-,23+,24+,26-,27-/m1/s1
InChIKeyZFOQFRWXAGFXFL-IWRPRKENSA-O
Species of MetaboliteComponentSourceComments
Colletotrichum incanum (ncbitaxon:1573173) - PubMed (32663020)
ChEBI Ontology
Outgoing Relation(s)
CIML D (CHEBI:221546) is a phosphocholines (CHEBI:36700)