| Properties | Image |
|---|
| MNX_ID | MNXM345239 |
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| reference | slm:000005580 |
| formula | C52H93NO10P |
| global charge | -1 |
| mol weight | 923.287 |
| InChIKey | KXHZEJLEHKSSOM-SCVPECKRSA-M |
| InChI | InChI=1S/C52H94NO10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-51(55)63-48(46-61-64(58,59)62-47-49(53)52(56)57)45-60-50(54)43-41-39-37-10-8-6-4-2/h11-12,14-15,17-18,20-21,48-49H,3-10,13,16,19,22-47,53H2,1-2H3,(H,56,57)(H,58,59)/p-1/b12-11-,15-14-,18-17-,21-20-/t48-,49+/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC)COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C52H94NO10P/c1-3-5-7-9-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-51(55)63-48(46-61-64(58,59)62-47-49(53)52(56)57)45-60-50(54)43-41-39-37-10-8-6-4-2/h11-12,14-15,17-18,20-21,48-49H,3-10,13,16,19,22-47,53H2,1-2H3,(H,56,57)(H,58,59)/b12-11-,15-14-,18-17-,21-20-/t48-,49+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][C:51](=[O:55])[O:63][C@H:48]([CH2:45][O:60][C:50]([CH2:43][CH2:41][CH2:39][CH2:37][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:54])[CH2:46][O:61][P:64]([OH:58])(=[O:59])[O:62][CH2:47][C@@H:49]([C:52](=[O:56])[OH:57])[NH2:53] |
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