| Properties | Image |
|---|
| MNX_ID | MNXM1181010 |
 |
| reference | envipathM:...180431681875 |
| formula | C35H55O14 |
| global charge | -1 |
| mol weight | 699.811 |
| InChIKey | OWELPYDAXIEEMY-UHFFFAOYSA-M |
| InChI | InChI=1S/C35H56O14/c1-16-30(43)22(37)12-29(46-16)49-31-17(2)47-28(13-23(31)38)48-19-9-18-5-6-20-21(32(18,3)25(39)10-19)11-26(40)33(4)24(7-8-35(20,33)45)34(44,15-36)14-27(41)42/h16-21,23-26,28-31,36,38-40,43-45H,5-15H2,1-4H3,(H,41,42)/p-1 |
| SMILES | CC1OC(OC2C(O)CC(OC3CC(O)C4(C)C(CCC5C4CC(O)C4(C)C(C(O)(CO)CC(=O)[O-])CCC54O)C3)OC2C)CC(=O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C35H56O14/c1-16-30(43)22(37)12-29(46-16)49-31-17(2)47-28(13-23(31)38)48-19-9-18-5-6-20-21(32(18,3)25(39)10-19)11-26(40)33(4)24(7-8-35(20,33)45)34(44,15-36)14-27(41)42/h16-21,23-26,28-31,36,38-40,43-45H,5-15H2,1-4H3,(H,41,42)/t16?,17?,18?,19?,20?,21?,23?,24?,25?,26?,28?,29?,30?,31?,32?,33?,34?,35? |
 |
| SMILES (mnx) | [CH3:1][CH:16]1[CH:30]([OH:43])[C:22](=[O:37])[CH2:12][CH:29]([O:49][CH:31]2[CH:17]([CH3:2])[O:47][CH:28]([O:48][CH:19]3[CH2:9][CH:18]4[CH2:5][CH2:6][CH:20]5[CH:21]([CH2:11][CH:26]([OH:40])[C:33]6([CH3:4])[CH:24]([C:34]([CH2:14][C:27](=[O:41])[OH:42])([CH2:15][OH:36])[OH:44])[CH2:7][CH2:8][C:35]56[OH:45])[C:32]4([CH3:3])[CH:25]([OH:39])[CH2:10]3)[CH2:13][CH:23]2[OH:38])[O:46]1 |
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