| Properties | Image |
|---|
| MNX_ID | MNXM1173953 |
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| reference | envipathM:...fc771480765c |
| formula | C26H43O8 |
| global charge | -1 |
| mol weight | 483.622 |
| InChIKey | KIUTVMFURLMCDR-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H44O8/c1-4-14-17-8-13(28)9-20(30)26(17,3)18-10-21(31)25(2)15(5-6-16(25)22(18)23(14)32)12(11-27)7-19(29)24(33)34/h12-23,27-32H,4-11H2,1-3H3,(H,33,34)/p-1 |
| SMILES | CCC1C(O)C2C3CCC(C(CO)CC(O)C(=O)[O-])C3(C)C(O)CC2C2(C)C(O)CC(O)CC12 |
MNX internals
| InChI (mnx) | InChI=1/C26H44O8/c1-4-14-17-8-13(28)9-20(30)26(17,3)18-10-21(31)25(2)15(5-6-16(25)22(18)23(14)32)12(11-27)7-19(29)24(33)34/h12-23,27-32H,4-11H2,1-3H3,(H,33,34)/t12?,13?,14?,15?,16?,17?,18?,19?,20?,21?,22?,23?,25?,26? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH:14]1[CH:17]2[CH2:8][CH:13]([OH:28])[CH2:9][CH:20]([OH:30])[C:26]2([CH3:3])[CH:18]2[CH2:10][CH:21]([OH:31])[C:25]3([CH3:2])[CH:15]([CH:12]([CH2:7][CH:19]([C:24](=[O:33])[OH:34])[OH:29])[CH2:11][OH:27])[CH2:5][CH2:6][CH:16]3[CH:22]2[CH:23]1[OH:32] |
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