| Properties | Image |
|---|
| MNX_ID | MNXM967010 |
 |
| reference | slm:000659395 |
| formula | C63H107NO9P |
| global charge | -1 |
| mol weight | 1053.521 |
| InChIKey | IIPJPGXCQRWJAY-OKVXSIJNSA-M |
| InChI | InChI=1S/C63H108NO9P/c1-4-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-55-62(66)70-58-60(73-63(67)53-6-3)59-72-74(68,69)71-57-56-64-61(65)54-51-49-47-45-43-41-39-37-22-20-18-16-14-12-10-8-5-2/h13-16,19-22,24-25,27-28,39,41,45,47,60H,4-12,17-18,23,26,29-38,40,42-44,46,48-59H2,1-3H3,(H,64,65)(H,68,69)/p-1/b15-13-,16-14-,21-19-,22-20-,25-24-,28-27-,41-39-,47-45-/t60-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCC |
MNX internals
| InChI (mnx) | InChI=1/C63H108NO9P/c1-4-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-55-62(66)70-58-60(73-63(67)53-6-3)59-72-74(68,69)71-57-56-64-61(65)54-51-49-47-45-43-41-39-37-22-20-18-16-14-12-10-8-5-2/h13-16,19-22,24-25,27-28,39,41,45,47,60H,4-12,17-18,23,26,29-38,40,42-44,46,48-59H2,1-3H3,(H,64,65)(H,68,69)/b15-13-,16-14-,21-19-,22-20-,25-24-,28-27-,41-39-,47-45-/t60-/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:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29][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][CH2:55][C:62](=[O:66])[O:70][CH2:58][C@H:60]([CH2:59][O:72][P:74]([OH:68])(=[O:69])[O:71][CH2:57][CH2:56][N:64]=[C:61]([CH2:54][CH2:51][CH2:49]/[CH:47]=[CH:45]\[CH2:43]/[CH:41]=[CH:39]\[CH2:37]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:5][CH3:2])[OH:65])[O:73][C:63]([CH2:53][CH2:6][CH3:3])=[O:67] |
|