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CL(10:0/11:0/a-15:0/23:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM1419274Image of MNXM1419274
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC68H132O17P2
charge0
mass1283.733
referencehmdb:HMDB0188372
InChIKeySCVMXGMLDJTTTI-PBWVKRSGSA-N
InChIInChI=1S/C68H132O17P2/c1-6-10-13-16-19-21-22-23-24-25-26-27-28-29-30-31-32-39-44-49-54-68(73)85-64(58-79-66(71)52-47-42-38-34-33-36-40-45-50-61(5)9-4)60-83-87(76,77)81-56-62(69)55-80-86(74,75)82-59-63(57-78-65(70)51-46-41-35-18-15-12-8-3)84-67(72)53-48-43-37-20-17-14-11-7-2/h61-64,69H,6-60H2,1-5H3,(H,74,75)(H,76,77)/t61?,62-,63+,64+/m0/s1
SMILES[CH3:1][CH2:6][CH2:10][CH2:13][CH2:16][CH2:19][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:39][CH2:44][CH2:49][CH2:54][C:68](=[O:73])[O:85][C@H:64]([CH2:58][O:79][C:66]([CH2:52][CH2:47][CH2:42][CH2:38][CH2:34][CH2:33][CH2:36][CH2:40][CH2:45][CH2:50][CH:61]([CH3:5])[CH2:9][CH3:4])=[O:71])[CH2:60][O:83][P:87]([OH:76])(=[O:77])[O:81][CH2:56][C@H:62]([CH2:55][O:80][P:86]([OH:74])(=[O:75])[O:82][CH2:59][C@@H:63]([CH2:57][O:78][C:65]([CH2:51][CH2:46][CH2:41][CH2:35][CH2:18][CH2:15][CH2:12][CH2:8][CH3:3])=[O:70])[O:84][C:67]([CH2:53][CH2:48][CH2:43][CH2:37][CH2:20][CH2:17][CH2:14][CH2:11][CH2:7][CH3:2])=[O:72])[OH:69]
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Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0188372 CL(10:0/11:0/a-15:0/23:0)
(2S)-3-{[(2R)-3-(decanoyloxy)-2-(undecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy((2R)-3-[(12-methyltetradecanoyl)oxy]-2-(tricosanoyloxy)propoxy)phosphinic acid
[(2S)-3-({[(2R)-3-(decanoyloxy)-2-(undecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-[(12-methyltetradecanoyl)oxy]-2-(tricosanoyloxy)propoxy]phosphinate
[(2S)-3-({[(2R)-3-(decanoyloxy)-2-(undecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-3-[(12-methyltetradecanoyl)oxy]-2-(tricosanoyloxy)propoxy]phosphinic acid