| Properties | Image |
|---|
| MNX_ID | MNXM1139235 |
 |
| reference | envipathM:...4e1eeaa3f2a3 |
| formula | C29H41O11 |
| global charge | -1 |
| mol weight | 565.636 |
| InChIKey | LYSKRHBKVCDIGC-UHFFFAOYSA-M |
| InChI | InChI=1S/C29H42O11/c1-14-25(36)20(31)11-24(39-14)40-16-9-21(32)26(2)19-10-22(33)27(3)17(15(13-30)8-23(34)35)5-7-29(27,38)18(19)4-6-28(26,37)12-16/h8,14,16-19,21-22,24,30,32-33,37-38H,4-7,9-13H2,1-3H3,(H,34,35)/p-1 |
| SMILES | CC1OC(OC2CC(O)C3(C)C4CC(O)C5(C)C(C(=CC(=O)[O-])CO)CCC5(O)C4CCC3(O)C2)CC(=O)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C29H42O11/c1-14-25(36)20(31)11-24(39-14)40-16-9-21(32)26(2)19-10-22(33)27(3)17(15(13-30)8-23(34)35)5-7-29(27,38)18(19)4-6-28(26,37)12-16/h8,14,16-19,21-22,24,30,32-33,37-38H,4-7,9-13H2,1-3H3,(H,34,35)/b15-8?/t14?,16?,17?,18?,19?,21?,22?,24?,26?,27?,28?,29? |
 |
| SMILES (mnx) | [CH3:1][CH:14]1[C:25](=[O:36])[C:20](=[O:31])[CH2:11][CH:24]([O:40][CH:16]2[CH2:9][CH:21]([OH:32])[C:26]3([CH3:2])[CH:19]4[CH2:10][CH:22]([OH:33])[C:27]5([CH3:3])[CH:17]([C:15](=[CH:8][C:23](=[O:34])[OH:35])[CH2:13][OH:30])[CH2:5][CH2:7][C:29]5([OH:38])[CH:18]4[CH2:4][CH2:6][C:28]3([OH:37])[CH2:12]2)[O:39]1 |
|