| Properties | Image |
|---|
| MNX_ID | MNXM1232580 |
 |
| reference | envipathM:...19c106669efd |
| formula | C26H43O6 |
| global charge | -1 |
| mol weight | 451.624 |
| InChIKey | UGMQWWCEEUJRQX-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H44O6/c1-4-17-20-13-16(28)7-10-24(20,2)19-8-11-25(3)18(15(14-27)5-6-21(29)30)9-12-26(25,32)22(19)23(17)31/h15-20,22-23,27-28,31-32H,4-14H2,1-3H3,(H,29,30)/p-1 |
| SMILES | CCC1C(O)C2C(CCC3(C)C(C(CO)CCC(=O)[O-])CCC23O)C2(C)CCC(O)CC12 |
MNX internals
| InChI (mnx) | InChI=1/C26H44O6/c1-4-17-20-13-16(28)7-10-24(20,2)19-8-11-25(3)18(15(14-27)5-6-21(29)30)9-12-26(25,32)22(19)23(17)31/h15-20,22-23,27-28,31-32H,4-14H2,1-3H3,(H,29,30)/t15?,16?,17?,18?,19?,20?,22?,23?,24?,25?,26? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH:17]1[CH:20]2[CH2:13][CH:16]([OH:28])[CH2:7][CH2:10][C:24]2([CH3:2])[CH:19]2[CH2:8][CH2:11][C:25]3([CH3:3])[CH:18]([CH:15]([CH2:5][CH2:6][C:21](=[O:29])[OH:30])[CH2:14][OH:27])[CH2:9][CH2:12][C:26]3([OH:32])[CH:22]2[CH:23]1[OH:31] |
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