| Properties | Image |
|---|
| MNX_ID | MNXM1042237 |
 |
| reference | slm:000734626 |
| formula | C45H85NO8P |
| global charge | -1 |
| mol weight | 799.148 |
| InChIKey | CAEZWDLVRQLJHI-YDTWIKRVSA-M |
| InChI | InChI=1S/C45H86NO8P/c1-4-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-36-39-51-41-44(54-43(3)47)42-53-55(49,50)52-40-38-46-45(48)37-35-33-31-29-27-25-23-19-17-15-13-11-9-7-5-2/h15,17-18,20,44H,4-14,16,19,21-42H2,1-3H3,(H,46,48)(H,49,50)/p-1/b17-15-,20-18-/t44-/m1/s1 |
| SMILES | CCCCCC/C=C\CCCCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCC/C=C\CCCCCCCC)OC(C)=O |
MNX internals
| InChI (mnx) | InChI=1/C45H86NO8P/c1-4-6-8-10-12-14-16-18-20-21-22-24-26-28-30-32-34-36-39-51-41-44(54-43(3)47)42-53-55(49,50)52-40-38-46-45(48)37-35-33-31-29-27-25-23-19-17-15-13-11-9-7-5-2/h15,17-18,20,44H,4-14,16,19,21-42H2,1-3H3,(H,46,48)(H,49,50)/b17-15-,20-18-/t44-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:6][CH2:8][CH2:10][CH2:12][CH2:14][CH2:16]/[CH:18]=[CH:20]\[CH2:21][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:39][O:51][CH2:41][C@H:44]([CH2:42][O:53][P:55]([OH:49])(=[O:50])[O:52][CH2:40][CH2:38][N:46]=[C:45]([CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:9][CH2:7][CH2:5][CH3:2])[OH:48])[O:54][C:43]([CH3:3])=[O:47] |
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