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CHEBI:187687 - 1-(8-[3]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol)

ChEBI IDCHEBI:187687
ChEBI Name1-(8-[3]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol)
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC46H79O8P
Net Charge0
Average Mass791.104
Monoisotopic Mass790.55126
SMILESO=P(O)(OC[C@@H](O)CO)OC[C@@H](COCCCCCCCCC1CCC2C(C1)C1C3CCC3C21)OCCCCCCCCC1CCC2C(C1)C1C3CCC3C21
InChIInChI=1S/C46H79O8P/c47-27-33(48)28-53-55(49,50)54-30-34(52-24-12-8-4-2-6-10-14-32-16-18-40-42(26-32)46-38-22-20-36(38)44(40)46)29-51-23-11-7-3-1-5-9-13-31-15-17-39-41(25-31)45-37-21-19-35(37)43(39)45/h31-48H,1-30H2,(H,49,50)/t31?,32?,33-,34+,35?,36?,37?,38?,39?,40?,41?,42?,43?,44?,45?,46?/m0/s1
InChIKeyQIHVXBHEEVTVOD-GQSXMAELSA-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-[3]-ladderane-octanyl)-2-(8-[3]-ladderane-octanyl)-sn-glycero-3-phospho-(1'-sn-glycerol) (CHEBI:187687) is a glycerophosphoglycerols (CHEBI:24360)
IUPAC Name 
[(2R)-2,3-bis[8-(10-tetracyclo[6.4.0.02,7.03,6]dodecanyl)octoxy]propyl] [(2S)-2,3-dihydroxypropyl] hydrogen phosphate
Manual XrefsDatabases
LMGP04040005LIPID MAPS
24823100ChemSpider