| Properties | Image |
|---|
| MNX_ID | MNXM1182175 |
 |
| reference | envipathM:...90e141d45620 |
| formula | C26H41O7 |
| global charge | -1 |
| mol weight | 465.607 |
| InChIKey | RMYXXYIKGWEBSH-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H42O7/c1-4-25(32)19-13-16(28)7-10-23(19,2)18-8-11-24(3)17(15(14-27)5-6-20(29)30)9-12-26(24,33)21(18)22(25)31/h14-19,21-22,28,31-33H,4-13H2,1-3H3,(H,29,30)/p-1 |
| SMILES | CCC1(O)C(O)C2C(CCC3(C)C(C(C=O)CCC(=O)[O-])CCC23O)C2(C)CCC(O)CC21 |
MNX internals
| InChI (mnx) | InChI=1/C26H42O7/c1-4-25(32)19-13-16(28)7-10-23(19,2)18-8-11-24(3)17(15(14-27)5-6-20(29)30)9-12-26(24,33)21(18)22(25)31/h14-19,21-22,28,31-33H,4-13H2,1-3H3,(H,29,30)/t15?,16?,17?,18?,19?,21?,22?,23?,24?,25?,26? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][C:25]1([OH:32])[CH:19]2[CH2:13][CH:16]([OH:28])[CH2:7][CH2:10][C:23]2([CH3:2])[CH:18]2[CH2:8][CH2:11][C:24]3([CH3:3])[CH:17]([CH:15]([CH2:5][CH2:6][C:20](=[O:29])[OH:30])[CH:14]=[O:27])[CH2:9][CH2:12][C:26]3([OH:33])[CH:21]2[CH:22]1[OH:31] |
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