| Properties | Image |
|---|
| MNX_ID | MNXM342419 |
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| reference | slm:000018981 |
| formula | C41H70O13P |
| global charge | -1 |
| mol weight | 801.972 |
| InChIKey | RCXGUPJPUKMZKM-APCMTRHGSA-M |
| InChI | InChI=1S/C41H71O13P/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)53-34(31-51-33(2)42)32-52-55(49,50)54-41-39(47)37(45)36(44)38(46)40(41)48/h7-8,10-11,13-14,16-17,34,36-41,44-48H,3-6,9,12,15,18-32H2,1-2H3,(H,49,50)/p-1/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](O)[C@H](O)[C@H]1O |
MNX internals
| InChI (mnx) | InChI=1/C41H71O13P/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)53-34(31-51-33(2)42)32-52-55(49,50)54-41-39(47)37(45)36(44)38(46)40(41)48/h7-8,10-11,13-14,16-17,34,36-41,44-48H,3-6,9,12,15,18-32H2,1-2H3,(H,49,50)/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:53][C@H:34]([CH2:31][O:51][C:33]([CH3:2])=[O:42])[CH2:32][O:52][P:55]([OH:49])(=[O:50])[O:54][C@@H:41]1[C@H:39]([OH:47])[C@H:37]([OH:45])[C@@H:36]([OH:44])[C@H:38]([OH:46])[C@H:40]1[OH:48] |
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