Search MNXref
 Feedback

1-O-(13-methyltetradecyl)-2-triacontanoyl-sn-glycero-3-phospho-N-(9Z,12Z,15Z-octadecatrienoyl)-ethanolamine

PropertiesImage
MNX_IDMNXM1028330 Image of MNXM1028330
referenceslm:000720719
formulaC68H129NO8P
global charge-1
mol weight1119.753
InChIKeyBGMULVYMIYKYGB-VHWBUIAHSA-M
InChIInChI=1S/C68H130NO8P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-34-36-38-43-47-51-55-59-68(71)77-66(63-74-61-56-52-48-44-40-39-41-45-49-53-57-65(3)4)64-76-78(72,73)75-62-60-69-67(70)58-54-50-46-42-37-35-33-20-18-16-14-12-10-8-6-2/h8,10,14,16,20,33,65-66H,5-7,9,11-13,15,17-19,21-32,34-64H2,1-4H3,(H,69,70)(H,72,73)/p-1/b10-8-,16-14-,33-20-/t66-/m1/s1
SMILESCC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC
MNX internals
InChI (mnx)InChI=1/C68H130NO8P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-34-36-38-43-47-51-55-59-68(71)77-66(63-74-61-56-52-48-44-40-39-41-45-49-53-57-65(3)4)64-76-78(72,73)75-62-60-69-67(70)58-54-50-46-42-37-35-33-20-18-16-14-12-10-8-6-2/h8,10,14,16,20,33,65-66H,5-7,9,11-13,15,17-19,21-32,34-64H2,1-4H3,(H,69,70)(H,72,73)/b10-8-,16-14-,33-20-/t66-/m1/s1 Image of MNXM1028330
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][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:43][CH2:47][CH2:51][CH2:55][CH2:59][C:68](=[O:71])[O:77][C@H:66]([CH2:63][O:74][CH2:61][CH2:56][CH2:52][CH2:48][CH2:44][CH2:40][CH2:39][CH2:41][CH2:45][CH2:49][CH2:53][CH2:57][CH:65]([CH3:3])[CH3:4])[CH2:64][O:76][P:78]([OH:72])(=[O:73])[O:75][CH2:62][CH2:60][N:69]=[C:67]([CH2:58][CH2:54][CH2:50][CH2:46][CH2:42][CH2:37][CH2:35]/[CH:33]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH3:2])[OH:70]
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:000720719
slm:000720719
BGMULVYMIYKYGB-VHWBUIAHSA-M
1-O-(13-methyltetradecyl)-2-triacontanoyl-sn-glycero-3-phospho-N-(9Z,12Z,15Z-octadecatrienoyl)-ethanolamine
N-(9Z,12Z,15Z-octadecatrienoyl)-1-O-(13-methyltetradecyl)-2-triacontanoyl-sn-glycero-3-phosphoethanolamine
NAPE (O-15:0(13-me)/30:0/18:3(9Z,12Z,15Z))