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CL(10:0/13:0/a-13:0/i-18:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM1420621Image of MNXM1420621
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC63H122O17P2
charge0
mass1213.598
referencehmdb:HMDB0189720
InChIKeyPQNQBPXXNPQLRR-ZZKAMXMPSA-N
InChIInChI=1S/C63H122O17P2/c1-7-10-12-14-16-17-23-27-35-41-47-62(67)79-58(51-73-60(65)45-39-33-25-15-13-11-8-2)53-77-81(69,70)75-49-57(64)50-76-82(71,72)78-54-59(52-74-61(66)46-40-34-30-29-32-38-44-56(6)9-3)80-63(68)48-42-36-28-24-21-19-18-20-22-26-31-37-43-55(4)5/h55-59,64H,7-54H2,1-6H3,(H,69,70)(H,71,72)/t56?,57-,58+,59+/m0/s1
SMILES[CH3:1][CH2:7][CH2:10][CH2:12][CH2:14][CH2:16][CH2:17][CH2:23][CH2:27][CH2:35][CH2:41][CH2:47][C:62](=[O:67])[O:79][C@H:58]([CH2:51][O:73][C:60]([CH2:45][CH2:39][CH2:33][CH2:25][CH2:15][CH2:13][CH2:11][CH2:8][CH3:2])=[O:65])[CH2:53][O:77][P:81]([OH:69])(=[O:70])[O:75][CH2:49][C@@H:57]([CH2:50][O:76][P:82]([OH:71])(=[O:72])[O:78][CH2:54][C@@H:59]([CH2:52][O:74][C:61]([CH2:46][CH2:40][CH2:34][CH2:30][CH2:29][CH2:32][CH2:38][CH2:44][CH:56]([CH3:6])[CH2:9][CH3:3])=[O:66])[O:80][C:63]([CH2:48][CH2:42][CH2:36][CH2:28][CH2:24][CH2:21][CH2:19][CH2:18][CH2:20][CH2:22][CH2:26][CH2:31][CH2:37][CH2:43][CH:55]([CH3:4])[CH3:5])=[O:68])[OH:64]
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Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0189720 CL(10:0/13:0/a-13:0/i-18:0)
(2S)-3-{[(2R)-3-(decanoyloxy)-2-(tridecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy((2R)-3-[(10-methyldodecanoyl)oxy]-2-[(16-methylheptadecanoyl)oxy]propoxy)phosphinic acid
[(2S)-3-({[(2R)-3-(decanoyloxy)-2-(tridecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-[(10-methyldodecanoyl)oxy]-2-[(16-methylheptadecanoyl)oxy]propoxy]phosphinate
[(2S)-3-({[(2R)-3-(decanoyloxy)-2-(tridecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-[(10-methyldodecanoyl)oxy]-2-[(16-methylheptadecanoyl)oxy]propoxy]phosphinic acid