| Properties | Image |
|---|
| MNX_ID | MNXM1046303 |
 |
| reference | slm:000738692 |
| formula | C55H103NO8P |
| global charge | -1 |
| mol weight | 937.402 |
| InChIKey | JXTBILKSQIWRHA-ZMWGBUDJSA-M |
| InChI | InChI=1S/C55H104NO8P/c1-4-7-10-13-16-19-22-24-26-28-30-33-36-39-42-45-49-61-51-53(64-55(58)47-44-41-38-35-32-29-27-25-23-20-17-14-11-8-5-2)52-63-65(59,60)62-50-48-56-54(57)46-43-40-37-34-31-21-18-15-12-9-6-3/h13,16-17,20,25,27,53H,4-12,14-15,18-19,21-24,26,28-52H2,1-3H3,(H,56,57)(H,59,60)/p-1/b16-13-,20-17-,27-25-/t53-/m1/s1 |
| SMILES | CCCC/C=C\CCCCCCCCCCCCOC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C55H104NO8P/c1-4-7-10-13-16-19-22-24-26-28-30-33-36-39-42-45-49-61-51-53(64-55(58)47-44-41-38-35-32-29-27-25-23-20-17-14-11-8-5-2)52-63-65(59,60)62-50-48-56-54(57)46-43-40-37-34-31-21-18-15-12-9-6-3/h13,16-17,20,25,27,53H,4-12,14-15,18-19,21-24,26,28-52H2,1-3H3,(H,56,57)(H,59,60)/b16-13-,20-17-,27-25-/t53-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10]/[CH:13]=[CH:16]\[CH2:19][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][CH2:49][O:61][CH2:51][C@H:53]([CH2:52][O:63][P:65]([OH:59])(=[O:60])[O:62][CH2:50][CH2:48][N:56]=[C:54]([CH2:46][CH2:43][CH2:40][CH2:37][CH2:34][CH2:31][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:57])[O:64][C:55]([CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:29]/[CH:27]=[CH:25]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:58] |
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