| Properties | Image |
MNX_ID | MNXM193286 |
 |
reference | slm:000008163 |
formula | C54H94NO8P |
global charge | 0 |
mol weight | 916.319 |
InChIKey | AJHLDSZGEMQPTC-NHTZZPNYSA-N |
InChI | InChI=1S/C54H94NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-28-29-31-32-34-36-38-40-42-44-46-53(56)60-50-52(51-62-64(58,59)61-49-48-55(3,4)5)63-54(57)47-45-43-41-39-37-35-33-30-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,25-26,28-29,52H,6-7,9,11-13,18-19,24,27,30-51H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-,26-25-,29-28-/t52-/m1/s1 |
SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCC/C=C\C/C=C\CCCCC |
MNX internals
InChI (mnx) | InChI=1/C54H94NO8P/c1-6-8-10-12-14-16-18-20-22-24-25-26-27-28-29-31-32-34-36-38-40-42-44-46-53(56)60-50-52(51-62-64(58,59)61-49-48-55(3,4)5)63-54(57)47-45-43-41-39-37-35-33-30-23-21-19-17-15-13-11-9-7-2/h8,10,14-17,20-23,25-26,28-29,52H,6-7,9,11-13,18-19,24,27,30-51H2,1-5H3/b10-8-,16-14-,17-15-,22-20-,23-21-,26-25-,29-28-/t52-/m1/s1 |
 |
SMILES (mnx) | [CH3:1][CH2:6]/[CH:8]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:31][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:53](=[O:56])[O:60][CH2:50][C@H:52]([CH2:51][O:62][P:64](=[O:58])([O-:59])[O:61][CH2:49][CH2:48][N+:55]([CH3:3])([CH3:4])[CH3:5])[O:63][C:54]([CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:30]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:9][CH2:7][CH3:2])=[O:57] |
|