| Properties | Image |
|---|
| MNX_ID | MNXM222834 |
 |
| reference | slm:000002464 |
| formula | C52H87NO10P |
| global charge | -1 |
| mol weight | 917.239 |
| InChIKey | IQNPYBLLNYKQAE-KJLKQSMBSA-M |
| InChI | InChI=1S/C52H88NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-42-44-51(55)63-48(46-61-64(58,59)62-47-49(53)52(56)57)45-60-50(54)43-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17-20,23-24,28,30,34,36,48-49H,3-4,6,8-10,12,14-16,21-22,25-27,29,31-33,35,37-47,53H2,1-2H3,(H,56,57)(H,58,59)/p-1/b7-5-,13-11-,19-17-,20-18-,24-23-,30-28-,36-34-/t48-,49+/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C52H88NO10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-26-28-30-32-34-36-38-40-42-44-51(55)63-48(46-61-64(58,59)62-47-49(53)52(56)57)45-60-50(54)43-41-39-37-35-33-31-29-27-25-22-20-18-16-14-12-10-8-6-4-2/h5,7,11,13,17-20,23-24,28,30,34,36,48-49H,3-4,6,8-10,12,14-16,21-22,25-27,29,31-33,35,37-47,53H2,1-2H3,(H,56,57)(H,58,59)/b7-5-,13-11-,19-17-,20-18-,24-23-,30-28-,36-34-/t48-,49+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:26]/[CH:28]=[CH:30]\[CH2:32]/[CH:34]=[CH: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][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:22]/[CH:20]=[CH:18]\[CH2:16][CH2:14][CH2:12][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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