| Properties | Image |
|---|
| MNX_ID | MNXM1245759 |
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| reference | envipathM:...17d25dd253b5 |
| formula | C35H51O14 |
| global charge | -1 |
| mol weight | 695.779 |
| InChIKey | YHHRPONVEWASOY-UHFFFAOYSA-M |
| InChI | InChI=1S/C35H52O14/c1-16-30(43)22(37)11-28(46-16)49-31-17(2)47-27(12-23(31)38)48-19-5-7-32(3)21-10-25(40)33(4)20(18(15-36)9-26(41)42)6-8-35(33,45)29(21)24(39)14-34(32,44)13-19/h9,16-17,19-21,23-25,27-29,31,36,38-40,44-45H,5-8,10-15H2,1-4H3,(H,41,42)/p-1 |
| SMILES | CC1OC(OC2C(O)CC(OC3CCC4(C)C5CC(O)C6(C)C(C(=CC(=O)[O-])CO)CCC6(O)C5C(O)CC4(O)C3)OC2C)CC(=O)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C35H52O14/c1-16-30(43)22(37)11-28(46-16)49-31-17(2)47-27(12-23(31)38)48-19-5-7-32(3)21-10-25(40)33(4)20(18(15-36)9-26(41)42)6-8-35(33,45)29(21)24(39)14-34(32,44)13-19/h9,16-17,19-21,23-25,27-29,31,36,38-40,44-45H,5-8,10-15H2,1-4H3,(H,41,42)/b18-9?/t16?,17?,19?,20?,21?,23?,24?,25?,27?,28?,29?,31?,32?,33?,34?,35? |
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| SMILES (mnx) | [CH3:1][CH:16]1[C:30](=[O:43])[C:22](=[O:37])[CH2:11][CH:28]([O:49][CH:31]2[CH:17]([CH3:2])[O:47][CH:27]([O:48][CH:19]3[CH2:5][CH2:7][C:32]4([CH3:3])[CH:21]5[CH2:10][CH:25]([OH:40])[C:33]6([CH3:4])[CH:20]([C:18](=[CH:9][C:26](=[O:41])[OH:42])[CH2:15][OH:36])[CH2:6][CH2:8][C:35]6([OH:45])[CH:29]5[CH:24]([OH:39])[CH2:14][C:34]4([OH:44])[CH2:13]3)[CH2:12][CH:23]2[OH:38])[O:46]1 |
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