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1-(11-methyldodecanoyl)-2-octacosanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)

PropertiesImage
MNX_IDMNXM188925 Image of MNXM188925
referenceslm:000036962
formulaC47H92O10P
global charge-1
mol weight848.217
InChIKeyYNYXNMVBQAIUFT-YWPUXERESA-M
InChIInChI=1S/C47H93O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-28-32-35-38-47(51)57-45(42-56-58(52,53)55-40-44(49)39-48)41-54-46(50)37-34-31-29-26-27-30-33-36-43(2)3/h43-45,48-49H,4-42H2,1-3H3,(H,52,53)/p-1/t44-,45+/m0/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCC(C)C)COP(=O)([O-])OC[C@@H](O)CO
MNX internals
InChI (mnx)InChI=1/C47H93O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-28-32-35-38-47(51)57-45(42-56-58(52,53)55-40-44(49)39-48)41-54-46(50)37-34-31-29-26-27-30-33-36-43(2)3/h43-45,48-49H,4-42H2,1-3H3,(H,52,53)/t44-,45+/m0/s1 Image of MNXM188925
SMILES (mnx)[CH3:1][CH2:4][CH2:5][CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:28][CH2:32][CH2:35][CH2:38][C:47](=[O:51])[O:57][C@H:45]([CH2:41][O:54][C:46]([CH2:37][CH2:34][CH2:31][CH2:29][CH2:26][CH2:27][CH2:30][CH2:33][CH2:36][CH:43]([CH3:2])[CH3:3])=[O:50])[CH2:42][O:56][P:58]([OH:52])(=[O:53])[O:55][CH2:40][C@H:44]([CH2:39][OH:48])[OH:49]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

SLM:000036962
slm:000036962
YNYXNMVBQAIUFT-YWPUXERESA-M
1-(11-methyldodecanoyl)-2-octacosanoyl-sn-glycero-3-phospho-(1'-sn-glycerol)
PG(13:0/28:0)
Phosphatidylglycerol (13:0/28:0)