| Properties | Image |
|---|
| MNX_ID | MNXM1178801 |
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| reference | envipathM:...9b2d5abd3914 |
| formula | C26H41O7 |
| global charge | -1 |
| mol weight | 465.607 |
| InChIKey | KXMFUKDWMOGKRC-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H42O7/c1-5-15-16-12-14(27)6-9-23(16,2)18-7-10-24(3)19(26(18,33)22(15)31)13-17(28)21(24)25(4,32)11-8-20(29)30/h15-19,21-22,28,31-33H,5-13H2,1-4H3,(H,29,30)/p-1 |
| SMILES | CCC1C2CC(=O)CCC2(C)C2CCC3(C)C(C(C)(O)CCC(=O)[O-])C(O)CC3C2(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C26H42O7/c1-5-15-16-12-14(27)6-9-23(16,2)18-7-10-24(3)19(26(18,33)22(15)31)13-17(28)21(24)25(4,32)11-8-20(29)30/h15-19,21-22,28,31-33H,5-13H2,1-4H3,(H,29,30)/t15?,16?,17?,18?,19?,21?,22?,23?,24?,25?,26? |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH:15]1[CH:16]2[CH2:12][C:14](=[O:27])[CH2:6][CH2:9][C:23]2([CH3:2])[CH:18]2[CH2:7][CH2:10][C:24]3([CH3:3])[CH:19]([CH2:13][CH:17]([OH:28])[CH:21]3[C:25]([CH3:4])([CH2:11][CH2:8][C:20](=[O:29])[OH:30])[OH:32])[C:26]2([OH:33])[CH:22]1[OH:31] |
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