| Properties | Image |
|---|
| MNX_ID | MNXM1182559 |
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| reference | envipathM:...5d5e534d2c4b |
| formula | C26H41O7 |
| global charge | -1 |
| mol weight | 465.607 |
| InChIKey | OCRMUHZCWKLNFW-UHFFFAOYSA-M |
| InChI | InChI=1S/C26H42O7/c1-5-15-17-12-22(30)33-11-10-24(17,3)19-13-20(27)25(4)16(14(2)6-9-21(28)29)7-8-18(25)26(19,32)23(15)31/h14-20,23,27,31-32H,5-13H2,1-4H3,(H,28,29)/p-1 |
| SMILES | CCC1C2CC(=O)OCCC2(C)C2CC(O)C3(C)C(C(C)CCC(=O)[O-])CCC3C2(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C26H42O7/c1-5-15-17-12-22(30)33-11-10-24(17,3)19-13-20(27)25(4)16(14(2)6-9-21(28)29)7-8-18(25)26(19,32)23(15)31/h14-20,23,27,31-32H,5-13H2,1-4H3,(H,28,29)/t14?,15?,16?,17?,18?,19?,20?,23?,24?,25?,26? |
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| SMILES (mnx) | [CH3:1][CH2:5][CH:15]1[CH:17]2[CH2:12][C:22](=[O:30])[O:33][CH2:11][CH2:10][C:24]2([CH3:3])[CH:19]2[CH2:13][CH:20]([OH:27])[C:25]3([CH3:4])[CH:16]([CH:14]([CH3:2])[CH2:6][CH2:9][C:21](=[O:28])[OH:29])[CH2:7][CH2:8][CH:18]3[C:26]2([OH:32])[CH:23]1[OH:31] |
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