| Properties | Image |
|---|
| MNX_ID | MNXM301047 |
 |
| reference | slm:000018024 |
| formula | C59H96O13P |
| global charge | -1 |
| mol weight | 1044.378 |
| InChIKey | LXMWWKJPJMCVES-OLUHNLIYSA-M |
| InChI | InChI=1S/C59H97O13P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-48-53(61)71-51(50-70-73(67,68)72-59-57(65)55(63)54(62)56(64)58(59)66)49-69-52(60)47-45-43-41-39-37-35-33-31-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,22-23,25-26,28-29,33,35,51,54-59,62-66H,3-5,7,9-10,15-16,21,24,27,30-32,34,36-50H2,1-2H3,(H,67,68)/p-1/b8-6-,13-11-,14-12-,19-17-,20-18-,23-22-,26-25-,29-28-,35-33-/t51-,54-,55-,56+,57-,58-,59-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)OC[C@H](COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O)OC(=O)CCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C59H97O13P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-48-53(61)71-51(50-70-73(67,68)72-59-57(65)55(63)54(62)56(64)58(59)66)49-69-52(60)47-45-43-41-39-37-35-33-31-20-18-16-14-12-10-8-6-4-2/h6,8,11-14,17-20,22-23,25-26,28-29,33,35,51,54-59,62-66H,3-5,7,9-10,15-16,21,24,27,30-32,34,36-50H2,1-2H3,(H,67,68)/b8-6-,13-11-,14-12-,19-17-,20-18-,23-22-,26-25-,29-28-,35-33-/t51-,54-,55-,56+,57-,58-,59-/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:22]=[CH:23]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][C:53](=[O:61])[O:71][C@H:51]([CH2:49][O:69][C:52]([CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37]/[CH:35]=[CH:33]\[CH2:31]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:60])[CH2:50][O:70][P:73]([OH:67])(=[O:68])[O:72][C@@H:59]1[C@H:57]([OH:65])[C@H:55]([OH:63])[C@@H:54]([OH:62])[C@H:56]([OH:64])[C@H:58]1[OH:66] |
|