| Properties | Image |
|---|
| MNX_ID | MNXM1178527 |
 |
| reference | envipathM:...3ed583cfb562 |
| formula | C26H41O7 |
| global charge | -1 |
| mol weight | 465.607 |
| InChIKey | YZEHPLJWOBYAOK-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H42O7/c1-4-16-19-12-15(28)5-8-24(19,2)18-6-9-25(3)17(14(13-27)11-20(29)23(31)32)7-10-26(25,33)21(18)22(16)30/h13-22,28-30,33H,4-12H2,1-3H3,(H,31,32)/p-1 |
| SMILES | CCC1C(O)C2C(CCC3(C)C(C(C=O)CC(O)C(=O)[O-])CCC23O)C2(C)CCC(O)CC12 |
MNX internals
| InChI (mnx) | InChI=1/C26H42O7/c1-4-16-19-12-15(28)5-8-24(19,2)18-6-9-25(3)17(14(13-27)11-20(29)23(31)32)7-10-26(25,33)21(18)22(16)30/h13-22,28-30,33H,4-12H2,1-3H3,(H,31,32)/t14?,15?,16?,17?,18?,19?,20?,21?,22?,24?,25?,26? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH:16]1[CH:19]2[CH2:12][CH:15]([OH:28])[CH2:5][CH2:8][C:24]2([CH3:2])[CH:18]2[CH2:6][CH2:9][C:25]3([CH3:3])[CH:17]([CH:14]([CH2:11][CH:20]([C:23](=[O:31])[OH:32])[OH:29])[CH:13]=[O:27])[CH2:7][CH2:10][C:26]3([OH:33])[CH:21]2[CH:22]1[OH:30] |
|