| Properties | Image |
|---|
| MNX_ID | MNXM345213 |
 |
| reference | slm:000498175 |
| formula | C53H96NO8P |
| global charge | 0 |
| mol weight | 906.324 |
| InChIKey | XAVDQDRFXGBHML-HIPHXFGWSA-N |
| InChI | InChI=1S/C53H96NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-53(56)62-51(50-61-63(57,58)60-48-47-54)49-59-52(55)45-43-41-39-10-8-6-4-2/h11-12,14-15,17-18,20-21,23-24,51H,3-10,13,16,19,22,25-50,54H2,1-2H3,(H,57,58)/b12-11-,15-14-,18-17-,21-20-,24-23-/t51-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC)COP(=O)([O-])OCC[NH3+] |
MNX internals
| InChI (mnx) | InChI=1/C53H96NO8P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-53(56)62-51(50-61-63(57,58)60-48-47-54)49-59-52(55)45-43-41-39-10-8-6-4-2/h11-12,14-15,17-18,20-21,23-24,51H,3-10,13,16,19,22,25-50,54H2,1-2H3,(H,57,58)/b12-11-,15-14-,18-17-,21-20-,24-23-/t51-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:53](=[O:56])[O:62][C@H:51]([CH2:49][O:59][C:52]([CH2:45][CH2:43][CH2:41][CH2:39][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:55])[CH2:50][O:61][P:63]([OH:57])(=[O:58])[O:60][CH2:48][CH2:47][NH2:54] |
|