| Properties | Image |
|---|
| MNX_ID | MNXM1183983 |
 |
| reference | envipathM:...299be6f8f45c |
| formula | C35H51O14 |
| global charge | -1 |
| mol weight | 695.779 |
| InChIKey | HUUHOMRIPWCTKG-UHFFFAOYSA-M |
| InChI | InChI=1S/C35H52O14/c1-15-31(44)23(38)11-29(46-15)49-32-16(2)47-28(12-24(32)39)48-18-5-6-33(3)19-10-26(41)34(4)30(17(14-36)7-27(42)43)25(40)13-35(34,45)20(19)9-22(37)21(33)8-18/h7,14-16,18-26,28-30,32,37-41,45H,5-6,8-13H2,1-4H3,(H,42,43)/p-1 |
| SMILES | CC1OC(OC2C(O)CC(OC3CCC4(C)C(C3)C(O)CC3C4CC(O)C4(C)C(C(C=O)=CC(=O)[O-])C(O)CC34O)OC2C)CC(O)C1=O |
MNX internals
| InChI (mnx) | InChI=1/C35H52O14/c1-15-31(44)23(38)11-29(46-15)49-32-16(2)47-28(12-24(32)39)48-18-5-6-33(3)19-10-26(41)34(4)30(17(14-36)7-27(42)43)25(40)13-35(34,45)20(19)9-22(37)21(33)8-18/h7,14-16,18-26,28-30,32,37-41,45H,5-6,8-13H2,1-4H3,(H,42,43)/b17-7?/t15?,16?,18?,19?,20?,21?,22?,23?,24?,25?,26?,28?,29?,30?,32?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH:15]1[C:31](=[O:44])[CH:23]([OH:38])[CH2:11][CH:29]([O:49][CH:32]2[CH:16]([CH3:2])[O:47][CH:28]([O:48][CH:18]3[CH2:5][CH2:6][C:33]4([CH3:3])[CH:19]5[CH2:10][CH:26]([OH:41])[C:34]6([CH3:4])[CH:30]([C:17](=[CH:7][C:27](=[O:42])[OH:43])[CH:14]=[O:36])[CH:25]([OH:40])[CH2:13][C:35]6([OH:45])[CH:20]5[CH2:9][CH:22]([OH:37])[CH:21]4[CH2:8]3)[CH2:12][CH:24]2[OH:39])[O:46]1 |
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