| Properties | Image |
|---|
| MNX_ID | MNXM1186978 |
 |
| reference | envipathM:...08f0307ee8e9 |
| formula | C41H64O18 |
| global charge | 0 |
| mol weight | 844.945 |
| InChIKey | ODDMADRTMJOZNE-UHFFFAOYSA-N |
| InChI | InChI=1S/C41H64O18/c1-16-32(47)23(42)12-29(53-16)57-35-18(3)55-30(14-25(35)44)58-34-17(2)54-28(13-24(34)43)56-19-10-26(45)38(4)22-11-27(46)39(5)21(31-33(48)37(50)59-36(31)49)7-9-41(39,52)20(22)6-8-40(38,51)15-19/h16-35,42-48,51-52H,6-15H2,1-5H3 |
| SMILES | CC1OC(OC2C(O)CC(OC3C(O)CC(OC4CC(O)C5(C)C6CC(O)C7(C)C(C8C(=O)OC(=O)C8O)CCC7(O)C6CCC5(O)C4)OC3C)OC2C)CC(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C41H64O18/c1-16-32(47)23(42)12-29(53-16)57-35-18(3)55-30(14-25(35)44)58-34-17(2)54-28(13-24(34)43)56-19-10-26(45)38(4)22-11-27(46)39(5)21(31-33(48)37(50)59-36(31)49)7-9-41(39,52)20(22)6-8-40(38,51)15-19/h16-35,42-48,51-52H,6-15H2,1-5H3/t16?,17?,18?,19?,20?,21?,22?,23?,24?,25?,26?,27?,28?,29?,30?,31?,32?,33?,34?,35?,38?,39?,40?,41? |
 |
| SMILES (mnx) | [CH3:1][CH:16]1[CH:32]([OH:47])[CH:23]([OH:42])[CH2:12][CH:29]([O:57][CH:35]2[CH:18]([CH3:3])[O:55][CH:30]([O:58][CH:34]3[CH:17]([CH3:2])[O:54][CH:28]([O:56][CH:19]4[CH2:10][CH:26]([OH:45])[C:38]5([CH3:4])[CH:22]6[CH2:11][CH:27]([OH:46])[C:39]7([CH3:5])[CH:21]([CH:31]8[CH:33]([OH:48])[C:37](=[O:50])[O:59][C:36]8=[O:49])[CH2:7][CH2:9][C:41]7([OH:52])[CH:20]6[CH2:6][CH2:8][C:40]5([OH:51])[CH2:15]4)[CH2:13][CH:24]3[OH:43])[CH2:14][CH:25]2[OH:44])[O:53]1 |
|