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1-O-triacontyl-2-(13-methyltetradecanoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1039707 Image of MNXM1039707
referenceslm:000732096
formulaC60H119NO8P
global charge-1
mol weight1013.585
InChIKeyLBWLYUJMXCKHMB-QPUWJJAWSA-M
InChIInChI=1S/C60H120NO8P/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-36-40-44-48-53-66-55-58(69-60(63)51-47-43-39-35-33-34-38-41-45-49-57(3)4)56-68-70(64,65)67-54-52-61-59(62)50-46-42-37-12-10-8-6-2/h57-58H,5-56H2,1-4H3,(H,61,62)(H,64,65)/p-1/t58-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC)OC(=O)CCCCCCCCCCCC(C)C
MNX internals
InChI (mnx)InChI=1/C60H120NO8P/c1-5-7-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-36-40-44-48-53-66-55-58(69-60(63)51-47-43-39-35-33-34-38-41-45-49-57(3)4)56-68-70(64,65)67-54-52-61-59(62)50-46-42-37-12-10-8-6-2/h57-58H,5-56H2,1-4H3,(H,61,62)(H,64,65)/t58-/m1/s1 Image of MNXM1039707
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][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][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:36][CH2:40][CH2:44][CH2:48][CH2:53][O:66][CH2:55][C@H:58]([CH2:56][O:68][P:70]([OH:64])(=[O:65])[O:67][CH2:54][CH2:52][N:61]=[C:59]([CH2:50][CH2:46][CH2:42][CH2:37][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])[OH:62])[O:69][C:60]([CH2:51][CH2:47][CH2:43][CH2:39][CH2:35][CH2:33][CH2:34][CH2:38][CH2:41][CH2:45][CH2:49][CH:57]([CH3:3])[CH3:4])=[O:63]
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:000732096
slm:000732096
LBWLYUJMXCKHMB-QPUWJJAWSA-M
1-O-triacontyl-2-(13-methyltetradecanoyl)-sn-glycero-3-phospho-N-decanoyl-ethanolamine
N-decanoyl-1-O-triacontyl-2-(13-methyltetradecanoyl)-sn-glycero-3-phosphoethanolamine
NAPE (O-30:0/15:0-13me/10:0)