| Properties | Image |
|---|
| MNX_ID | MNXM316745 |
 |
| reference | slm:000024928 |
| formula | C49H79O8P |
| global charge | -2 |
| mol weight | 827.137 |
| InChIKey | CWHCXIMOSKCRAW-ZCUYTEMNSA-L |
| InChI | InChI=1S/C49H81O8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-27-29-31-33-35-37-39-41-43-48(50)55-45-47(46-56-58(52,53)54)57-49(51)44-42-40-38-36-34-32-30-28-25-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-25,27-29,32,34,47H,3-10,15-16,21-22,26,30-31,33,35-46H2,1-2H3,(H2,52,53,54)/p-2/b13-11-,14-12-,19-17-,20-18-,24-23-,28-25-,29-27-,34-32-/t47-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C49H81O8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-27-29-31-33-35-37-39-41-43-48(50)55-45-47(46-56-58(52,53)54)57-49(51)44-42-40-38-36-34-32-30-28-25-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-25,27-29,32,34,47H,3-10,15-16,21-22,26,30-31,33,35-46H2,1-2H3,(H2,52,53,54)/b13-11-,14-12-,19-17-,20-18-,24-23-,28-25-,29-27-,34-32-/t47-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:26]/[CH:27]=[CH:29]\[CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][C:48](=[O:50])[O:55][CH2:45][C@H:47]([CH2:46][O:56][P:58]([OH:52])([OH:53])=[O:54])[O:57][C:49]([CH2:44][CH2:42][CH2:40][CH2:38][CH2:36]/[CH:34]=[CH:32]\[CH2:30]/[CH:28]=[CH:25]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:51] |
|