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CL(10:0/11:0/i-18:0/i-22:0)

PropertiesImageOccurences in reactions
MNX_IDMNXM1419429Image of MNXM1419429
#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
formulaC70H136O17P2
charge0
mass1311.787
referencehmdb:HMDB0188527
InChIKeyZTBHIBUHSFACQM-GLCCOQBGSA-N
InChIInChI=1S/C70H136O17P2/c1-7-9-11-13-15-35-42-48-54-69(74)86-65(58-80-67(72)52-46-40-32-14-12-10-8-2)60-84-88(76,77)82-56-64(71)57-83-89(78,79)85-61-66(59-81-68(73)53-47-41-36-30-26-23-22-25-29-34-39-45-51-63(5)6)87-70(75)55-49-43-37-31-27-21-19-17-16-18-20-24-28-33-38-44-50-62(3)4/h62-66,71H,7-61H2,1-6H3,(H,76,77)(H,78,79)/t64-,65+,66+/m0/s1
SMILES[CH3:1][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:35][CH2:42][CH2:48][CH2:54][C:69](=[O:74])[O:86][C@H:65]([CH2:58][O:80][C:67]([CH2:52][CH2:46][CH2:40][CH2:32][CH2:14][CH2:12][CH2:10][CH2:8][CH3:2])=[O:72])[CH2:60][O:84][P:88]([OH:76])(=[O:77])[O:82][CH2:56][C@@H:64]([CH2:57][O:83][P:89]([OH:78])(=[O:79])[O:85][CH2:61][C@@H:66]([CH2:59][O:81][C:68]([CH2:53][CH2:47][CH2:41][CH2:36][CH2:30][CH2:26][CH2:23][CH2:22][CH2:25][CH2:29][CH2:34][CH2:39][CH2:45][CH2:51][CH:63]([CH3:5])[CH3:6])=[O:73])[O:87][C:70]([CH2:55][CH2:49][CH2:43][CH2:37][CH2:31][CH2:27][CH2:21][CH2:19][CH2:17][CH2:16][CH2:18][CH2:20][CH2:24][CH2:28][CH2:33][CH2:38][CH2:44][CH2:50][CH:62]([CH3:3])[CH3:4])=[O:75])[OH:71]
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Similar chemical compounds in external resources
IdentifierDescription
hmdb:HMDB0188527 CL(10:0/11:0/i-18:0/i-22:0)
(2S)-3-{[(2R)-3-(decanoyloxy)-2-(undecanoyloxy)propoxy(hydroxy)phosphoryl]oxy}-2-hydroxypropoxy((2R)-2-[(20-methylhenicosanoyl)oxy]-3-[(16-methylheptadecanoyl)oxy]propoxy)phosphinic acid
[(2S)-3-({[(2R)-3-(decanoyloxy)-2-(undecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-2-[(20-methylhenicosanoyl)oxy]-3-[(16-methylheptadecanoyl)oxy]propoxy]phosphinate
[(2S)-3-({[(2R)-3-(decanoyloxy)-2-(undecanoyloxy)propoxy](hydroxy)phosphoryl}oxy)-2-hydroxypropoxy][(2R)-2-[(20-methylhenicosanoyl)oxy]-3-[(16-methylheptadecanoyl)oxy]propoxy]phosphinic acid