| Properties | Image |
|---|
| MNX_ID | MNXM335241 |
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| reference | slm:000005337 |
| formula | C54H103NO10P |
| global charge | -1 |
| mol weight | 957.389 |
| InChIKey | ZGJIDRYQKCFQAP-UQHJOBCSSA-M |
| InChI | InChI=1S/C54H104NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-53(57)65-50(48-63-66(60,61)64-49-51(55)54(58)59)47-62-52(56)45-43-41-39-37-35-33-31-18-16-14-12-10-8-6-4-2/h18,31,50-51H,3-17,19-30,32-49,55H2,1-2H3,(H,58,59)(H,60,61)/p-1/b31-18-/t50-,51+/m1/s1 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-])OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H104NO10P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-53(57)65-50(48-63-66(60,61)64-49-51(55)54(58)59)47-62-52(56)45-43-41-39-37-35-33-31-18-16-14-12-10-8-6-4-2/h18,31,50-51H,3-17,19-30,32-49,55H2,1-2H3,(H,58,59)(H,60,61)/b31-18-/t50-,51+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:53](=[O:57])[O:65][C@H:50]([CH2:47][O:62][C:52]([CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33]/[CH:31]=[CH:18]\[CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:56])[CH2:48][O:63][P:66]([OH:60])(=[O:61])[O:64][CH2:49][C@@H:51]([C:54](=[O:58])[OH:59])[NH2:55] |
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