| Properties | Image |
|---|
| MNX_ID | MNXM198795 |
 |
| reference | slm:000014843 |
| formula | C57H104O13P |
| global charge | -1 |
| mol weight | 1028.42 |
| InChIKey | WAPDVRLDRCJFGJ-RAXKJUSFSA-M |
| InChI | InChI=1S/C57H105O13P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-44-46-51(59)69-49(48-68-71(65,66)70-57-55(63)53(61)52(60)54(62)56(57)64)47-67-50(58)45-43-41-39-37-35-33-31-29-20-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,20,49,52-57,60-64H,3-5,7,9-11,13,15-17,19,21-48H2,1-2H3,(H,65,66)/p-1/b8-6-,14-12-,20-18-/t49-,52-,53-,54+,55-,56-,57-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=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)CCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C57H105O13P/c1-3-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-30-32-34-36-38-40-42-44-46-51(59)69-49(48-68-71(65,66)70-57-55(63)53(61)52(60)54(62)56(57)64)47-67-50(58)45-43-41-39-37-35-33-31-29-20-18-16-14-12-10-8-6-4-2/h6,8,12,14,18,20,49,52-57,60-64H,3-5,7,9-11,13,15-17,19,21-48H2,1-2H3,(H,65,66)/b8-6-,14-12-,20-18-/t49-,52-,53-,54+,55-,56-,57-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:51](=[O:59])[O:69][C@H:49]([CH2:47][O:67][C:50]([CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10]/[CH:8]=[CH:6]\[CH2:4][CH3:2])=[O:58])[CH2:48][O:68][P:71]([OH:65])(=[O:66])[O:70][C@@H:57]1[C@H:55]([OH:63])[C@H:53]([OH:61])[C@@H:52]([OH:60])[C@H:54]([OH:62])[C@H:56]1[OH:64] |
|