| Properties | Image |
|---|
| MNX_ID | MNXM1191374 |
 |
| reference | envipathM:...946802971992 |
| formula | C29H43O11 |
| global charge | -1 |
| mol weight | 567.652 |
| InChIKey | VMEKPMDRQCRUEG-UHFFFAOYSA-M |
| InChI | InChI=1S/C29H44O11/c1-14-25(36)20(31)11-24(39-14)40-17-6-7-26(2)15(8-17)4-5-18-19(26)10-21(32)27(3)28(18,37)12-22(33)29(27,38)16(13-30)9-23(34)35/h9,14-15,17-21,24-25,30-32,36-38H,4-8,10-13H2,1-3H3,(H,34,35)/p-1 |
| SMILES | CC1OC(OC2CCC3(C)C(CCC4C3CC(O)C3(C)C(O)(C(=CC(=O)[O-])CO)C(=O)CC43O)C2)CC(O)C1O |
MNX internals
| InChI (mnx) | InChI=1/C29H44O11/c1-14-25(36)20(31)11-24(39-14)40-17-6-7-26(2)15(8-17)4-5-18-19(26)10-21(32)27(3)28(18,37)12-22(33)29(27,38)16(13-30)9-23(34)35/h9,14-15,17-21,24-25,30-32,36-38H,4-8,10-13H2,1-3H3,(H,34,35)/b16-9?/t14?,15?,17?,18?,19?,20?,21?,24?,25?,26?,27?,28?,29? |
 |
| SMILES (mnx) | [CH3:1][CH:14]1[CH:25]([OH:36])[CH:20]([OH:31])[CH2:11][CH:24]([O:40][CH:17]2[CH2:6][CH2:7][C:26]3([CH3:2])[CH:15]([CH2:4][CH2:5][CH:18]4[CH:19]3[CH2:10][CH:21]([OH:32])[C:27]3([CH3:3])[C:28]4([OH:37])[CH2:12][C:22](=[O:33])[C:29]3([C:16](=[CH:9][C:23](=[O:34])[OH:35])[CH2:13][OH:30])[OH:38])[CH2:8]2)[O:39]1 |
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