| Properties | Image |
|---|
| MNX_ID | MNXM1037221 |
 |
| reference | slm:000729610 |
| formula | C71H127NO8P |
| global charge | -1 |
| mol weight | 1153.77 |
| InChIKey | XKDGUMPESNRBJC-CSHMBMAUSA-M |
| InChI | InChI=1S/C71H128NO8P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-38-40-43-46-49-52-55-58-61-65-77-67-69(80-71(74)63-60-57-54-51-48-45-41-27-24-21-18-15-12-9-6-3)68-79-81(75,76)78-66-64-72-70(73)62-59-56-53-50-47-44-42-39-37-31-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,37,39,44,47,53,56,69H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-36,38,40-43,45-46,48-52,54-55,57-68H2,1-3H3,(H,72,73)(H,75,76)/p-1/b11-8-,20-17-,24-21-,29-26-,39-37-,47-44-,56-53-/t69-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCCCC/C=C\CCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C71H128NO8P/c1-4-7-10-13-16-19-22-25-28-30-32-33-34-35-36-38-40-43-46-49-52-55-58-61-65-77-67-69(80-71(74)63-60-57-54-51-48-45-41-27-24-21-18-15-12-9-6-3)68-79-81(75,76)78-66-64-72-70(73)62-59-56-53-50-47-44-42-39-37-31-29-26-23-20-17-14-11-8-5-2/h8,11,17,20-21,24,26,29,37,39,44,47,53,56,69H,4-7,9-10,12-16,18-19,22-23,25,27-28,30-36,38,40-43,45-46,48-52,54-55,57-68H2,1-3H3,(H,72,73)(H,75,76)/b11-8-,20-17-,24-21-,29-26-,39-37-,47-44-,56-53-/t69-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:30][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][CH2:65][O:77][CH2:67][C@H:69]([CH2:68][O:79][P:81]([OH:75])(=[O:76])[O:78][CH2:66][CH2:64][N:72]=[C:70]([CH2:62][CH2:59]/[CH:56]=[CH:53]\[CH2:50]/[CH:47]=[CH:44]\[CH2:42]/[CH:39]=[CH:37]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH:73])[O:80][C:71]([CH2:63][CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:41][CH2:27]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:74] |
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