| Properties | Image |
|---|
| MNX_ID | MNXM193497 |
 |
| reference | slm:000030596 |
| formula | C55H98NO8P |
| global charge | 0 |
| mol weight | 932.362 |
| InChIKey | CJGMDQXWKOGOOB-XTNIFVSQSA-N |
| InChI | InChI=1S/C55H98NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-28-29-31-33-35-37-39-41-43-45-47-54(57)61-51-53(52-63-65(59,60)62-50-49-56)64-55(58)48-46-44-42-40-38-36-34-32-30-27-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17-20,23,25,28-29,53H,3-4,6,8-10,12,14-16,21-22,24,26-27,30-52,56H2,1-2H3,(H,59,60)/b7-5-,13-11-,19-17-,20-18-,25-23-,29-28-/t53-/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[NH3+])OC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C55H98NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-28-29-31-33-35-37-39-41-43-45-47-54(57)61-51-53(52-63-65(59,60)62-50-49-56)64-55(58)48-46-44-42-40-38-36-34-32-30-27-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17-20,23,25,28-29,53H,3-4,6,8-10,12,14-16,21-22,24,26-27,30-52,56H2,1-2H3,(H,59,60)/b7-5-,13-11-,19-17-,20-18-,25-23-,29-28-/t53-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:26]/[CH:28]=[CH:29]\[CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][C:54](=[O:57])[O:61][CH2:51][C@H:53]([CH2:52][O:63][P:65]([OH:59])(=[O:60])[O:62][CH2:50][CH2:49][NH2:56])[O:64][C:55]([CH2:48][CH2:46][CH2:44][CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:30][CH2:27][CH2:24][CH2:22]/[CH:20]=[CH:18]\[CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:58] |
|