| Properties | Image |
|---|
| MNX_ID | MNXM342424 |
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| reference | slm:000469251 |
| formula | C41H68O19P3 |
| global charge | -5 |
| mol weight | 957.898 |
| InChIKey | DCQVSDDRVKFOJR-MGOQMOAGSA-I |
| InChI | InChI=1S/C41H73O19P3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-35(43)57-34(31-55-33(2)42)32-56-63(53,54)60-39-36(44)37(45)40(58-61(47,48)49)41(38(39)46)59-62(50,51)52/h7-8,10-11,13-14,16-17,34,36-41,44-46H,3-6,9,12,15,18-32H2,1-2H3,(H,53,54)(H2,47,48,49)(H2,50,51,52)/p-5/b8-7-,11-10-,14-13-,17-16-/t34-,36-,37+,38+,39-,40-,41-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)O[C@H](COC(C)=O)COP(=O)([O-])O[C@@H]1[C@H](O)[C@H](O)[C@@H](OP(=O)([O-])[O-])[C@H](OP(=O)([O-])[O-])[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C41H73O19P3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-35(43)57-34(31-55-33(2)42)32-56-63(53,54)60-39-36(44)37(45)40(58-61(47,48)49)41(38(39)46)59-62(50,51)52/h7-8,10-11,13-14,16-17,34,36-41,44-46H,3-6,9,12,15,18-32H2,1-2H3,(H,53,54)(H2,47,48,49)(H2,50,51,52)/b8-7-,11-10-,14-13-,17-16-/t34-,36-,37+,38+,39-,40-,41-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:4][CH2:5][CH2:6]/[CH:7]=[CH:8]\[CH2:9]/[CH:10]=[CH:11]\[CH2:12]/[CH:13]=[CH:14]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][C:35](=[O:43])[O:57][C@H:34]([CH2:31][O:55][C:33]([CH3:2])=[O:42])[CH2:32][O:56][P:63]([OH:53])(=[O:54])[O:60][C@@H:39]1[C@H:36]([OH:44])[C@H:37]([OH:45])[C@@H:40]([O:58][P:61]([OH:47])([OH:48])=[O:49])[C@H:41]([O:59][P:62]([OH:50])([OH:51])=[O:52])[C@H:38]1[OH:46] |
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