| Properties | Image |
|---|
| MNX_ID | MNXM335653 |
 |
| reference | slm:000475477 |
| formula | C40H69O13P2 |
| global charge | -3 |
| mol weight | 819.927 |
| InChIKey | OQTMPSPMQBGXJD-GGJNNMRMSA-K |
| InChI | InChI=1S/C40H72O13P2/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-30-32-40(43)53-38(36-52-55(47,48)51-34-37(41)33-50-54(44,45)46)35-49-39(42)31-29-27-25-23-21-14-12-10-8-6-4-2/h5,7,10-13,16-17,37-38,41H,3-4,6,8-9,14-15,18-36H2,1-2H3,(H,47,48)(H2,44,45,46)/p-3/b7-5-,12-10-,13-11-,17-16-/t37-,38+/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCC/C=C\CCCC)COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-] |
MNX internals
| InChI (mnx) | InChI=1/C40H72O13P2/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-24-26-28-30-32-40(43)53-38(36-52-55(47,48)51-34-37(41)33-50-54(44,45)46)35-49-39(42)31-29-27-25-23-21-14-12-10-8-6-4-2/h5,7,10-13,16-17,37-38,41H,3-4,6,8-9,14-15,18-36H2,1-2H3,(H,47,48)(H2,44,45,46)/b7-5-,12-10-,13-11-,17-16-/t37-,38+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18][CH2:19][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][C:40](=[O:43])[O:53][C@H:38]([CH2:35][O:49][C:39]([CH2:31][CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:14]/[CH:12]=[CH:10]\[CH2:8][CH2:6][CH2:4][CH3:2])=[O:42])[CH2:36][O:52][P:55]([OH:47])(=[O:48])[O:51][CH2:34][C@H:37]([CH2:33][O:50][P:54]([OH:44])([OH:45])=[O:46])[OH:41] |
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