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1-(11Z,14Z,17Z,20Z-hexacosatetraenoyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-N-hexadecanoyl-ethanolamine

PropertiesImage
MNX_IDMNXM963168 Image of MNXM963168
referenceslm:000655553
formulaC65H117NO9P
global charge-1
mol weight1087.623
InChIKeyQSVSLPFHVOUPPX-NLPNMIDXSA-M
InChIInChI=1S/C65H118NO9P/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-33-34-36-38-41-44-47-50-53-56-64(68)72-60-62(75-65(69)57-54-51-48-45-42-39-35-26-23-20-17-14-11-8-5-2)61-74-76(70,71)73-59-58-66-63(67)55-52-49-46-43-40-37-24-21-18-15-12-9-6-3/h16,19,25-27,29-30,32-33,35,62H,4-15,17-18,20-24,28,31,34,36-61H2,1-3H3,(H,66,67)(H,70,71)/p-1/b19-16-,27-25-,30-29-,33-32-,35-26-/t62-/m1/s1
SMILESCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC
MNX internals
InChI (mnx)InChI=1/C65H118NO9P/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-33-34-36-38-41-44-47-50-53-56-64(68)72-60-62(75-65(69)57-54-51-48-45-42-39-35-26-23-20-17-14-11-8-5-2)61-74-76(70,71)73-59-58-66-63(67)55-52-49-46-43-40-37-24-21-18-15-12-9-6-3/h16,19,25-27,29-30,32-33,35,62H,4-15,17-18,20-24,28,31,34,36-61H2,1-3H3,(H,66,67)(H,70,71)/b19-16-,27-25-,30-29-,33-32-,35-26-/t62-/m1/s1 Image of MNXM963168
SMILES (mnx)[CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31]/[CH:32]=[CH:33]\[CH2:34][CH2:36][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][C:64](=[O:68])[O:72][CH2:60][C@H:62]([CH2:61][O:74][P:76]([OH:70])(=[O:71])[O:73][CH2:59][CH2:58][N:66]=[C:63]([CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:67])[O:75][C:65]([CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39]/[CH:35]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:69]
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:000655553
slm:000655553
QSVSLPFHVOUPPX-NLPNMIDXSA-M
1-(11Z,14Z,17Z,20Z-hexacosatetraenoyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phospho-N-hexadecanoyl-ethanolamine
N-hexadecanoyl-1-(11Z,14Z,17Z,20Z-hexacosatetraenoyl)-2-(9Z-octadecenoyl)-sn-glycero-3-phosphoethanolamine
NAPE (26:4(11Z,14Z,17Z,20Z)/18:1(9Z)/16:0)