| Properties | Image |
|---|
| MNX_ID | MNXM955316 |
 |
| reference | slm:000647701 |
| formula | C55H95NO9P |
| global charge | -1 |
| mol weight | 945.337 |
| InChIKey | VSYGQYBLWMXHRW-OSYUEKLDSA-M |
| InChI | InChI=1S/C55H96NO9P/c1-4-7-10-13-16-19-22-24-26-28-31-33-36-39-42-45-53(57)56-48-49-63-66(60,61)64-51-52(65-55(59)47-44-41-38-35-30-21-18-15-12-9-6-3)50-62-54(58)46-43-40-37-34-32-29-27-25-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,24-27,32,34,52H,4-6,8-9,11-15,18,21-23,28-31,33,35-51H2,1-3H3,(H,56,57)(H,60,61)/p-1/b10-7-,19-16-,20-17-,26-24-,27-25-,34-32-/t52-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C55H96NO9P/c1-4-7-10-13-16-19-22-24-26-28-31-33-36-39-42-45-53(57)56-48-49-63-66(60,61)64-51-52(65-55(59)47-44-41-38-35-30-21-18-15-12-9-6-3)50-62-54(58)46-43-40-37-34-32-29-27-25-23-20-17-14-11-8-5-2/h7,10,16-17,19-20,24-27,32,34,52H,4-6,8-9,11-15,18,21-23,28-31,33,35-51H2,1-3H3,(H,56,57)(H,60,61)/b10-7-,19-16-,20-17-,26-24-,27-25-,34-32-/t52-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:24]=[CH:26]\[CH2:28][CH2:31][CH2:33][CH2:36][CH2:39][CH2:42][CH2:45][C:53](=[N:56][CH2:48][CH2:49][O:63][P:66]([OH:60])(=[O:61])[O:64][CH2:51][C@@H:52]([CH2:50][O:62][C:54]([CH2:46][CH2:43][CH2:40][CH2:37]/[CH:34]=[CH: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])[O:65][C:55]([CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:30][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:59])[OH:57] |
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