| Properties | Image |
|---|
| MNX_ID | MNXM1185278 |
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| reference | envipathM:...3f34fc62832a |
| formula | C26H43O7 |
| global charge | -1 |
| mol weight | 467.623 |
| InChIKey | ZZFMFGLOOJEGSY-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H44O7/c1-5-14-16-8-13(27)9-19(29)25(16,3)17-11-20(30)26(4)15(12(2)6-7-21(31)32)10-18(28)23(26)22(17)24(14)33/h12-20,22-24,27-30,33H,5-11H2,1-4H3,(H,31,32)/p-1 |
| SMILES | CCC1C(O)C2C(CC(O)C3(C)C(C(C)CCC(=O)[O-])CC(O)C23)C2(C)C(O)CC(O)CC12 |
MNX internals
| InChI (mnx) | InChI=1/C26H44O7/c1-5-14-16-8-13(27)9-19(29)25(16,3)17-11-20(30)26(4)15(12(2)6-7-21(31)32)10-18(28)23(26)22(17)24(14)33/h12-20,22-24,27-30,33H,5-11H2,1-4H3,(H,31,32)/t12?,13?,14?,15?,16?,17?,18?,19?,20?,22?,23?,24?,25?,26? |
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| SMILES (mnx) | [CH3:1][CH2:5][CH:14]1[CH:16]2[CH2:8][CH:13]([OH:27])[CH2:9][CH:19]([OH:29])[C:25]2([CH3:3])[CH:17]2[CH2:11][CH:20]([OH:30])[C:26]3([CH3:4])[CH:15]([CH:12]([CH3:2])[CH2:6][CH2:7][C:21](=[O:31])[OH:32])[CH2:10][CH:18]([OH:28])[CH:23]3[CH:22]2[CH:24]1[OH:33] |
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