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CHEBI:187189 - 1-(8-[5]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol)

ChEBI IDCHEBI:187189
ChEBI Name1-(8-[5]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC46H77O8P
Net Charge0
Average Mass789.088
Monoisotopic Mass788.53561
SMILESO=P(O)(OC[C@@H](O)CO)OC[C@@H](COCCCCCCCCC1CC2C1C1C3C4CCC4C3C21)OCCCCCCCCC1CCC2C(C1)C1C3CCC3C21
InChIInChI=1S/C46H77O8P/c47-25-31(48)26-53-55(49,50)54-28-32(52-22-12-8-4-1-5-9-13-29-15-16-37-38(23-29)42-34-18-17-33(34)41(37)42)27-51-21-11-7-3-2-6-10-14-30-24-39-40(30)46-44-36-20-19-35(36)43(44)45(39)46/h29-48H,1-28H2,(H,49,50)/t29?,30?,31-,32+,33?,34?,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?/m0/s1
InChIKeyKYOINKNHCGMCRF-SVSCMWPXSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
1-(8-[5]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:187189) is a glycerophosphoglycerols (CHEBI:24360)
IUPAC Name 
[(2S)-2,3-dihydroxypropyl] [(2R)-3-[8-(4-pentacyclo[6.4.0.02,7.03,6.09,12]dodecanyl)octoxy]-2-[8-(10-tetracyclo[6.4.0.02,7.03,6]dodecanyl)octoxy]propyl] hydrogen phosphate
Manual XrefsDatabases
LMGP04040004LIPID MAPS
24823099ChemSpider