| Properties | Image |
|---|
| MNX_ID | MNXM1182065 |
 |
| reference | envipathM:...a00c6d50f04e |
| formula | C26H41O7 |
| global charge | -1 |
| mol weight | 465.607 |
| InChIKey | IFMHHSGQWUPQCY-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H42O7/c1-15(4-7-21(29)30)18-5-6-20-23(18,2)11-12-25(32)24(3)10-8-16(28)14-19(24)17(9-13-27)22(31)26(20,25)33/h15-20,27-28,32-33H,4-14H2,1-3H3,(H,29,30)/p-1 |
| SMILES | CC(CCC(=O)[O-])C1CCC2C1(C)CCC1(O)C3(C)CCC(O)CC3C(CCO)C(=O)C21O |
MNX internals
| InChI (mnx) | InChI=1/C26H42O7/c1-15(4-7-21(29)30)18-5-6-20-23(18,2)11-12-25(32)24(3)10-8-16(28)14-19(24)17(9-13-27)22(31)26(20,25)33/h15-20,27-28,32-33H,4-14H2,1-3H3,(H,29,30)/t15?,16?,17?,18?,19?,20?,23?,24?,25?,26? |
 |
| SMILES (mnx) | [CH3:1][CH:15]([CH2:4][CH2:7][C:21](=[O:29])[OH:30])[CH:18]1[CH2:5][CH2:6][CH:20]2[C:23]1([CH3:2])[CH2:11][CH2:12][C:25]1([OH:32])[C:24]3([CH3:3])[CH2:10][CH2:8][CH:16]([OH:28])[CH2:14][CH:19]3[CH:17]([CH2:9][CH2:13][OH:27])[C:22](=[O:31])[C:26]21[OH:33] |
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