| Properties | Image |
|---|
| MNX_ID | MNXM1191470 |
 |
| reference | envipathM:...05ad83ba1440 |
| formula | C35H57O15 |
| global charge | -1 |
| mol weight | 717.826 |
| InChIKey | YZGSJSBCWNJWIP-UHFFFAOYSA-M |
| InChI | InChI=1S/C35H58O15/c1-16-29(43)20(37)10-27(47-16)50-30-17(2)48-26(11-21(30)38)49-18-5-7-31(3)19-9-24(40)32(4)23(33(44,15-36)14-25(41)42)6-8-35(32,46)28(19)22(39)13-34(31,45)12-18/h16-24,26-30,36-40,43-46H,5-15H2,1-4H3,(H,41,42)/p-1 |
| SMILES | CC1OC(OC2C(O)CC(OC3CCC4(C)C5CC(O)C6(C)C(C(O)(CO)CC(=O)[O-])CCC6(O)C5C(O)CC4(O)C3)OC2C)CC(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C35H58O15/c1-16-29(43)20(37)10-27(47-16)50-30-17(2)48-26(11-21(30)38)49-18-5-7-31(3)19-9-24(40)32(4)23(33(44,15-36)14-25(41)42)6-8-35(32,46)28(19)22(39)13-34(31,45)12-18/h16-24,26-30,36-40,43-46H,5-15H2,1-4H3,(H,41,42)/t16?,17?,18?,19?,20?,21?,22?,23?,24?,26?,27?,28?,29?,30?,31?,32?,33?,34?,35? |
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| SMILES (mnx) | [CH3:1][CH:16]1[CH:29]([OH:43])[CH:20]([OH:37])[CH2:10][CH:27]([O:50][CH:30]2[CH:17]([CH3:2])[O:48][CH:26]([O:49][CH:18]3[CH2:5][CH2:7][C:31]4([CH3:3])[CH:19]5[CH2:9][CH:24]([OH:40])[C:32]6([CH3:4])[CH:23]([C:33]([CH2:14][C:25](=[O:41])[OH:42])([CH2:15][OH:36])[OH:44])[CH2:6][CH2:8][C:35]6([OH:46])[CH:28]5[CH:22]([OH:39])[CH2:13][C:34]4([OH:45])[CH2:12]3)[CH2:11][CH:21]2[OH:38])[O:47]1 |
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