| Properties | Image |
|---|
| MNX_ID | MNXM1189540 |
 |
| reference | envipathM:...8d287a3e60fb |
| formula | C26H41O7 |
| global charge | -1 |
| mol weight | 465.607 |
| InChIKey | FCAKBDPQPOPDTO-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H42O7/c1-5-15-18-10-14(27)11-19(28)25(18,4)16-8-9-24(3)17(13(2)6-7-21(30)31)12-20(29)26(24,33)22(16)23(15)32/h13,15-20,22-23,28-29,32-33H,5-12H2,1-4H3,(H,30,31)/p-1 |
| SMILES | CCC1C(O)C2C(CCC3(C)C(C(C)CCC(=O)[O-])CC(O)C23O)C2(C)C(O)CC(=O)CC12 |
MNX internals
| InChI (mnx) | InChI=1/C26H42O7/c1-5-15-18-10-14(27)11-19(28)25(18,4)16-8-9-24(3)17(13(2)6-7-21(30)31)12-20(29)26(24,33)22(16)23(15)32/h13,15-20,22-23,28-29,32-33H,5-12H2,1-4H3,(H,30,31)/t13?,15?,16?,17?,18?,19?,20?,22?,23?,24?,25?,26? |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH:15]1[CH:18]2[CH2:10][C:14](=[O:27])[CH2:11][CH:19]([OH:28])[C:25]2([CH3:4])[CH:16]2[CH2:8][CH2:9][C:24]3([CH3:3])[CH:17]([CH:13]([CH3:2])[CH2:6][CH2:7][C:21](=[O:30])[OH:31])[CH2:12][CH:20]([OH:29])[C:26]3([OH:33])[CH:22]2[CH:23]1[OH:32] |
|