| Properties | Image |
|---|
| MNX_ID | MNXM1194482 |
 |
| reference | envipathM:...76eefcde7f9c |
| formula | C24H37O6 |
| global charge | -1 |
| mol weight | 421.554 |
| InChIKey | BOYKBOJILHPCRM-UHFFFAOYSA-M |
| InChI | InChI=1S/C24H38O6/c1-4-14-18-11-13(26)5-8-22(18,2)17-6-9-23(3)16(15(12-25)21(28)29)7-10-24(23,30)19(17)20(14)27/h14-20,25,27,30H,4-12H2,1-3H3,(H,28,29)/p-1 |
| SMILES | CCC1C(O)C2C(CCC3(C)C(C(CO)C(=O)[O-])CCC23O)C2(C)CCC(=O)CC12 |
MNX internals
| InChI (mnx) | InChI=1/C24H38O6/c1-4-14-18-11-13(26)5-8-22(18,2)17-6-9-23(3)16(15(12-25)21(28)29)7-10-24(23,30)19(17)20(14)27/h14-20,25,27,30H,4-12H2,1-3H3,(H,28,29)/t14?,15?,16?,17?,18?,19?,20?,22?,23?,24? |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH:14]1[CH:18]2[CH2:11][C:13](=[O:26])[CH2:5][CH2:8][C:22]2([CH3:2])[CH:17]2[CH2:6][CH2:9][C:23]3([CH3:3])[CH:16]([CH:15]([CH2:12][OH:25])[C:21](=[O:28])[OH:29])[CH2:7][CH2:10][C:24]3([OH:30])[CH:19]2[CH:20]1[OH:27] |
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