| Properties | Image |
| MNX_ID | MNXM1193600 |
 |
| reference | envipathM:...904d1b73532a |
| formula | C26H41O7 |
| global charge | -1 |
| mol weight | 465.607 |
| InChIKey | QZNXWIIAJWNACQ-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H42O7/c1-5-15-22(30)20-16(25(4)9-6-14(27)12-26(15,25)33)7-8-24(3)17(20)11-18(28)21(24)13(2)10-19(29)23(31)32/h13-17,19-22,27,29-30,33H,5-12H2,1-4H3,(H,31,32)/p-1 |
| SMILES | CCC1C(O)C2C3CC(=O)C(C(C)CC(O)C(=O)[O-])C3(C)CCC2C2(C)CCC(O)CC12O |
MNX internals
| InChI (mnx) | InChI=1/C26H42O7/c1-5-15-22(30)20-16(25(4)9-6-14(27)12-26(15,25)33)7-8-24(3)17(20)11-18(28)21(24)13(2)10-19(29)23(31)32/h13-17,19-22,27,29-30,33H,5-12H2,1-4H3,(H,31,32)/t13?,14?,15?,16?,17?,19?,20?,21?,22?,24?,25?,26? |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH:15]1[CH:22]([OH:30])[CH:20]2[CH:16]([CH2:7][CH2:8][C:24]3([CH3:3])[CH:17]2[CH2:11][C:18](=[O:28])[CH:21]3[CH:13]([CH3:2])[CH2:10][CH:19]([C:23](=[O:31])[OH:32])[OH:29])[C:25]2([CH3:4])[CH2:9][CH2:6][CH:14]([OH:27])[CH2:12][C:26]12[OH:33] |
|