| Properties | Image |
|---|
| MNX_ID | MNXM337166 |
 |
| reference | slm:000034809 |
| formula | C45H78NO8P |
| global charge | 0 |
| mol weight | 792.092 |
| InChIKey | DUZFVMHKZFPHEX-GHBMTAIISA-N |
| InChI | InChI=1S/C45H78NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-45(48)54-43(42-53-55(49,50)52-40-39-46)41-51-44(47)37-35-33-31-29-27-14-12-10-8-6-4-2/h10-13,16-17,19-20,22-23,25-26,43H,3-9,14-15,18,21,24,27-42,46H2,1-2H3,(H,49,50)/b12-10-,13-11-,17-16-,20-19-,23-22-,26-25-/t43-/m1/s1 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C45H78NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-25-26-28-30-32-34-36-38-45(48)54-43(42-53-55(49,50)52-40-39-46)41-51-44(47)37-35-33-31-29-27-14-12-10-8-6-4-2/h10-13,16-17,19-20,22-23,25-26,43H,3-9,14-15,18,21,24,27-42,46H2,1-2H3,(H,49,50)/b12-10-,13-11-,17-16-,20-19-,23-22-,26-25-/t43-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18]/[CH:19]=[CH:20]\[CH2:21]/[CH:22]=[CH:23]\[CH2:24]/[CH:25]=[CH:26]\[CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][C:45](=[O:48])[O:54][C@H:43]([CH2:41][O:51][C:44]([CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:14]/[CH:12]=[CH:10]\[CH2:8][CH2:6][CH2:4][CH3:2])=[O:47])[CH2:42][O:53][P:55]([OH:49])(=[O:50])[O:52][CH2:40][CH2:39][NH2:46] |
|