| Properties | Image |
|---|
| MNX_ID | MNXM966993 |
 |
| reference | slm:000659378 |
| formula | C64H105NO9P |
| global charge | -1 |
| mol weight | 1063.516 |
| InChIKey | MVBYWBXTCONASR-MBOPNALCSA-M |
| InChI | InChI=1S/C64H106NO9P/c1-4-7-9-11-13-15-17-19-21-23-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-54-56-64(68)71-59-61(74-63(67)6-3)60-73-75(69,70)72-58-57-65-62(66)55-53-51-49-47-45-43-41-39-37-24-22-20-18-16-14-12-10-8-5-2/h8,10,13-16,19-22,25-26,28-29,37,39,43,45,49,51,61H,4-7,9,11-12,17-18,23-24,27,30-36,38,40-42,44,46-48,50,52-60H2,1-3H3,(H,65,66)(H,69,70)/p-1/b10-8-,15-13-,16-14-,21-19-,22-20-,26-25-,29-28-,39-37-,45-43-,51-49-/t61-/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](COC(=O)CCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CC |
MNX internals
| InChI (mnx) | InChI=1/C64H106NO9P/c1-4-7-9-11-13-15-17-19-21-23-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-54-56-64(68)71-59-61(74-63(67)6-3)60-73-75(69,70)72-58-57-65-62(66)55-53-51-49-47-45-43-41-39-37-24-22-20-18-16-14-12-10-8-5-2/h8,10,13-16,19-22,25-26,28-29,37,39,43,45,49,51,61H,4-7,9,11-12,17-18,23-24,27,30-36,38,40-42,44,46-48,50,52-60H2,1-3H3,(H,65,66)(H,69,70)/b10-8-,15-13-,16-14-,21-19-,22-20-,26-25-,29-28-,39-37-,45-43-,51-49-/t61-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:23]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][C:64](=[O:68])[O:71][CH2:59][C@H:61]([CH2:60][O:73][P:75]([OH:69])(=[O:70])[O:72][CH2:58][CH2:57][N:65]=[C:62]([CH2:55][CH2:53]/[CH:51]=[CH:49]\[CH2:47]/[CH:45]=[CH:43]\[CH2:41]/[CH:39]=[CH:37]\[CH2:24]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:5][CH3:2])[OH:66])[O:74][C:63]([CH2:6][CH3:3])=[O:67] |
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