| Properties | Image |
|---|
| MNX_ID | MNXM1192068 |
 |
| reference | envipathM:...b4934db4a3f5 |
| formula | C29H49O13 |
| global charge | -1 |
| mol weight | 605.698 |
| InChIKey | DVNJEUWNJAQBLH-HCFRWAJISA-M |
| InChI | InChI=1S/C29H50O13/c1-10-19(31)29(8,39)24(34)14(2)21(32)18(13-30)11-27(6,38)23(33)15(3)22(16(4)26(36)37)42-20-12-28(7,40-9)25(35)17(5)41-20/h14-18,20,22,24-25,30,34-35,38-39H,10-13H2,1-9H3,(H,36,37)/p-1/t14-,15-,16+,17-,18-,20-,22-,24+,25-,27+,28+,29+/m0/s1 |
| SMILES | CCC(=O)[C@@](C)(O)[C@H](O)[C@@H](C)C(=O)[C@H](CO)C[C@@](C)(O)C(=O)[C@@H](C)[C@H](O[C@H]1C[C@@](C)(OC)[C@@H](O)[C@H](C)O1)[C@@H](C)C(=O)[O-] |
MNX internals
| InChI (mnx) | InChI=1/C29H50O13/c1-10-19(31)29(8,39)24(34)14(2)21(32)18(13-30)11-27(6,38)23(33)15(3)22(16(4)26(36)37)42-20-12-28(7,40-9)25(35)17(5)41-20/h14-18,20,22,24-25,30,34-35,38-39H,10-13H2,1-9H3,(H,36,37)/t14-,15-,16+,17-,18-,20-,22-,24+,25-,27+,28+,29+/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:10][C:19]([C@:29]([CH3:8])([C@@H:24]([C@@H:14]([CH3:2])[C:21]([C@@H:18]([CH2:11][C@:27]([CH3:6])([C:23]([C@@H:15]([CH3:3])[C@@H:22]([C@@H:16]([CH3:4])[C:26](=[O:36])[OH:37])[O:42][C@H:20]1[CH2:12][C@@:28]([CH3:7])([O:40][CH3:9])[C@@H:25]([OH:35])[C@H:17]([CH3:5])[O:41]1)=[O:33])[OH:38])[CH2:13][OH:30])=[O:32])[OH:34])[OH:39])=[O:31] |
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