| Properties | Image |
|---|
| MNX_ID | MNXM1177131 |
 |
| reference | envipathM:...b63feb53c282 |
| formula | C24H38O6 |
| global charge | -2 |
| mol weight | 422.562 |
| InChIKey | JVFJLUCUQLCUPF-UHFFFAOYSA-L |
| InChI | InChI=1S/C24H40O6/c1-5-15(22(29)30)19-12-14(25)8-10-24(19,4)18-9-11-23(3)16(13(2)21(27)28)6-7-17(23)20(18)26/h13-20,25-26H,5-12H2,1-4H3,(H,27,28)(H,29,30)/p-2 |
| SMILES | CCC(C(=O)[O-])C1CC(O)CCC1(C)C1CCC2(C)C(C(C)C(=O)[O-])CCC2C1O |
MNX internals
| InChI (mnx) | InChI=1/C24H40O6/c1-5-15(22(29)30)19-12-14(25)8-10-24(19,4)18-9-11-23(3)16(13(2)21(27)28)6-7-17(23)20(18)26/h13-20,25-26H,5-12H2,1-4H3,(H,27,28)(H,29,30)/t13?,14?,15?,16?,17?,18?,19?,20?,23?,24? |
 |
| SMILES (mnx) | [CH3:1][CH2:5][CH:15]([CH:19]1[CH2:12][CH:14]([OH:25])[CH2:8][CH2:10][C:24]1([CH3:4])[CH:18]1[CH2:9][CH2:11][C:23]2([CH3:3])[CH:16]([CH:13]([CH3:2])[C:21](=[O:27])[OH:28])[CH2:6][CH2:7][CH:17]2[CH:20]1[OH:26])[C:22](=[O:29])[OH:30] |
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