| Properties | Image |
|---|
| MNX_ID | MNXM186476 |
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| reference | slm:000001594 |
| formula | C49H85NO10P |
| global charge | -1 |
| mol weight | 879.19 |
| InChIKey | SBTVFRXVLPPGIB-XDLPWTQRSA-M |
| InChI | InChI=1S/C49H86NO10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-30-34-37-40-48(52)60-45(42-58-61(55,56)59-43-46(50)49(53)54)41-57-47(51)39-36-33-31-28-29-32-35-38-44(2)3/h5-6,8-9,11-12,14-15,17-18,44-46H,4,7,10,13,16,19-43,50H2,1-3H3,(H,53,54)(H,55,56)/p-1/b6-5-,9-8-,12-11-,15-14-,18-17-/t45-,46+/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCC(C)C)COP(=O)([O-])OC[C@H]([NH3+])C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C49H86NO10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-30-34-37-40-48(52)60-45(42-58-61(55,56)59-43-46(50)49(53)54)41-57-47(51)39-36-33-31-28-29-32-35-38-44(2)3/h5-6,8-9,11-12,14-15,17-18,44-46H,4,7,10,13,16,19-43,50H2,1-3H3,(H,53,54)(H,55,56)/b6-5-,9-8-,12-11-,15-14-,18-17-/t45-,46+/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:5]=[CH:6]\[CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:30][CH2:34][CH2:37][CH2:40][C:48](=[O:52])[O:60][C@H:45]([CH2:41][O:57][C:47]([CH2:39][CH2:36][CH2:33][CH2:31][CH2:28][CH2:29][CH2:32][CH2:35][CH2:38][CH:44]([CH3:2])[CH3:3])=[O:51])[CH2:42][O:58][P:61]([OH:55])(=[O:56])[O:59][CH2:43][C@@H:46]([C:49](=[O:53])[OH:54])[NH2:50] |
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