| Properties | Image |
|---|
| MNX_ID | MNXM955533 |
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| reference | slm:000647918 |
| formula | C55H91NO9P |
| global charge | -1 |
| mol weight | 941.305 |
| InChIKey | SEBMNZXQTYNPJB-PNRMUASZSA-M |
| InChI | InChI=1S/C55H92NO9P/c1-4-7-10-12-14-16-18-20-22-23-24-25-26-27-28-29-31-33-35-37-39-41-44-47-55(59)65-52(51-64-66(60,61)63-49-48-56-53(57)45-42-9-6-3)50-62-54(58)46-43-40-38-36-34-32-30-21-19-17-15-13-11-8-5-2/h7,10,14-17,20-22,24-25,27-28,30,34,36,52H,4-6,8-9,11-13,18-19,23,26,29,31-33,35,37-51H2,1-3H3,(H,56,57)(H,60,61)/p-1/b10-7-,16-14-,17-15-,22-20-,25-24-,28-27-,30-21-,36-34-/t52-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C55H92NO9P/c1-4-7-10-12-14-16-18-20-22-23-24-25-26-27-28-29-31-33-35-37-39-41-44-47-55(59)65-52(51-64-66(60,61)63-49-48-56-53(57)45-42-9-6-3)50-62-54(58)46-43-40-38-36-34-32-30-21-19-17-15-13-11-8-5-2/h7,10,14-17,20-22,24-25,27-28,30,34,36,52H,4-6,8-9,11-13,18-19,23,26,29,31-33,35,37-51H2,1-3H3,(H,56,57)(H,60,61)/b10-7-,16-14-,17-15-,22-20-,25-24-,28-27-,30-21-,36-34-/t52-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29][CH2:31][CH2:33][CH2:35][CH2:37][CH2:39][CH2:41][CH2:44][CH2:47][C:55](=[O:59])[O:65][C@H:52]([CH2:50][O:62][C:54]([CH2:46][CH2:43][CH2:40][CH2:38]/[CH:36]=[CH:34]\[CH2:32]/[CH:30]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13][CH2:11][CH2:8][CH2:5][CH3:2])=[O:58])[CH2:51][O:64][P:66]([OH:60])(=[O:61])[O:63][CH2:49][CH2:48][N:56]=[C:53]([CH2:45][CH2:42][CH2:9][CH2:6][CH3:3])[OH:57] |
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