| Properties | Image |
|---|
| MNX_ID | MNXM1185446 |
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| reference | envipathM:...e134d3114b5f |
| formula | C26H43O8 |
| global charge | -1 |
| mol weight | 483.622 |
| InChIKey | DWATYUBQFMCNGE-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H44O8/c1-4-14-16-7-13(28)8-19(30)25(16,2)17-10-20(31)26(3)15(12(11-27)5-6-21(32)33)9-18(29)23(26)22(17)24(14)34/h12-20,22-24,27-31,34H,4-11H2,1-3H3,(H,32,33)/p-1 |
| SMILES | CCC1C(O)C2C(CC(O)C3(C)C(C(CO)CCC(=O)[O-])CC(O)C23)C2(C)C(O)CC(O)CC12 |
MNX internals
| InChI (mnx) | InChI=1/C26H44O8/c1-4-14-16-7-13(28)8-19(30)25(16,2)17-10-20(31)26(3)15(12(11-27)5-6-21(32)33)9-18(29)23(26)22(17)24(14)34/h12-20,22-24,27-31,34H,4-11H2,1-3H3,(H,32,33)/t12?,13?,14?,15?,16?,17?,18?,19?,20?,22?,23?,24?,25?,26? |
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| SMILES (mnx) | [CH3:1][CH2:4][CH:14]1[CH:16]2[CH2:7][CH:13]([OH:28])[CH2:8][CH:19]([OH:30])[C:25]2([CH3:2])[CH:17]2[CH2:10][CH:20]([OH:31])[C:26]3([CH3:3])[CH:15]([CH:12]([CH2:5][CH2:6][C:21](=[O:32])[OH:33])[CH2:11][OH:27])[CH2:9][CH:18]([OH:29])[CH:23]3[CH:22]2[CH:24]1[OH:34] |
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