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1-O-(13-methyltetradecyl)-2-tetracosanoyl-sn-glycero-3-phospho-N-octadecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM1028287 Image of MNXM1028287
referenceslm:000720676
formulaC62H123NO8P
global charge-1
mol weight1041.639
InChIKeyRWCFXROUOPMRHG-AKAJXFOGSA-M
InChIInChI=1S/C62H124NO8P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-37-41-45-49-53-62(65)71-60(57-68-55-50-46-42-38-34-33-35-39-43-47-51-59(3)4)58-70-72(66,67)69-56-54-63-61(64)52-48-44-40-36-31-29-27-20-18-16-14-12-10-8-6-2/h59-60H,5-58H2,1-4H3,(H,63,64)(H,66,67)/p-1/t60-/m1/s1
SMILESCCCCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COCCCCCCCCCCCCC(C)C)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C62H124NO8P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-28-30-32-37-41-45-49-53-62(65)71-60(57-68-55-50-46-42-38-34-33-35-39-43-47-51-59(3)4)58-70-72(66,67)69-56-54-63-61(64)52-48-44-40-36-31-29-27-20-18-16-14-12-10-8-6-2/h59-60H,5-58H2,1-4H3,(H,63,64)(H,66,67)/t60-/m1/s1 Image of MNXM1028287
SMILES (mnx)[CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:28][CH2:30][CH2:32][CH2:37][CH2:41][CH2:45][CH2:49][CH2:53][C:62](=[O:65])[O:71][C@H:60]([CH2:57][O:68][CH2:55][CH2:50][CH2:46][CH2:42][CH2:38][CH2:34][CH2:33][CH2:35][CH2:39][CH2:43][CH2:47][CH2:51][CH:59]([CH3:3])[CH3:4])[CH2:58][O:70][P:72]([OH:66])(=[O:67])[O:69][CH2:56][CH2:54][N:63]=[C:61]([CH2:52][CH2:48][CH2:44][CH2:40][CH2:36][CH2:31][CH2:29][CH2:27][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])[OH:64]
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:000720676
slm:000720676
RWCFXROUOPMRHG-AKAJXFOGSA-M
1-O-(13-methyltetradecyl)-2-tetracosanoyl-sn-glycero-3-phospho-N-octadecanoyl-ethanolamine
N-octadecanoyl-1-O-(13-methyltetradecyl)-2-tetracosanoyl-sn-glycero-3-phosphoethanolamine
NAPE (O-15:0(13-me)/24:0/18:0)