| Properties | Image |
|---|
| MNX_ID | MNXM938758 |
 |
| reference | slm:000631143 |
| formula | C63H105NO9P |
| global charge | -1 |
| mol weight | 1051.505 |
| InChIKey | QHTVEBNRUXKUAJ-NZMZZSTGSA-M |
| InChI | InChI=1S/C63H106NO9P/c1-4-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-39-41-43-45-47-49-51-53-55-63(67)70-58-61(73-60(3)65)59-72-74(68,69)71-57-56-64-62(66)54-52-50-48-46-44-42-40-38-21-19-17-15-13-11-9-7-5-2/h6,8,12-15,18-21,23-24,26-27,40,42,46,48,61H,4-5,7,9-11,16-17,22,25,28-39,41,43-45,47,49-59H2,1-3H3,(H,64,66)(H,68,69)/p-1/b8-6-,14-12-,15-13-,20-18-,21-19-,24-23-,27-26-,42-40-,48-46-/t61-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(C)=O |
MNX internals
| InChI (mnx) | InChI=1/C63H106NO9P/c1-4-6-8-10-12-14-16-18-20-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-39-41-43-45-47-49-51-53-55-63(67)70-58-61(73-60(3)65)59-72-74(68,69)71-57-56-64-62(66)54-52-50-48-46-44-42-40-38-21-19-17-15-13-11-9-7-5-2/h6,8,12-15,18-21,23-24,26-27,40,42,46,48,61H,4-5,7,9-11,16-17,22,25,28-39,41,43-45,47,49-59H2,1-3H3,(H,64,66)(H,68,69)/b8-6-,14-12-,15-13-,20-18-,21-19-,24-23-,27-26-,42-40-,48-46-/t61-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:6]=[CH:8]\[CH2:10]/[CH:12]=[CH:14]\[CH2:16]/[CH:18]=[CH:20]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][CH2:55][C:63](=[O:67])[O:70][CH2:58][C@H:61]([CH2:59][O:72][P:74]([OH:68])(=[O:69])[O:71][CH2:57][CH2:56][N:64]=[C:62]([CH2:54][CH2:52][CH2:50]/[CH:48]=[CH:46]\[CH2:44]/[CH:42]=[CH:40]\[CH2:38]/[CH:21]=[CH:19]\[CH2:17]/[CH:15]=[CH:13]\[CH2:11][CH2:9][CH2:7][CH2:5][CH3:2])[OH:66])[O:73][C:60]([CH3:3])=[O:65] |
|