Primary Record
Tubeimoside I
- In stock
- 1,604 g
- Purity
- 98.2 %
- CAS
- 102040-03-9
Compound Identifiers & Properties
- CAS
- 102040-03-9
- PubChem CID
- 131954664
- SMILES
- CC1C2C(C(C(O1)O[C@@H]3[C@@H](C(CO[C@H]3OC(=O)C45CCC(CC4C6=CCC7C(C6(CC5)C)(CCC8C7(CC(C(C8(C)CO)OC9C(C(C(C(O9)CO)O)O)O[C@H]1[C@@H]([C@@H]([C@H](CO1)OC(=O)CC(CC(=O)O2)(C)O)O)O)O)C)C)(C)C)O)O)O)OC1C(C(C(CO1)O)O)O
- Canonical SMILES
- CC1OC2O[C@H]3[C@@H](OCC(O)[C@H]3O)OC(=O)C34CCC(C)(C)CC3C3=CCC5C6(C)CC(O)C(OC7OC(CO)C(O)C(O)C7O[C@@H]7OC[C@H](OC(=O)CC(C)(O)CC(=O)OC1C(OC1OCC(O)C(O)C1O)C2O)[C@@H](O)[C@H]7O)C(C)(CO)C6CCC5(C)C3(C)CC4
Names & Synonyms
- Tubeimoside I
- EBC-618463
- NCGC00485986-01
- PD052639
- 102040-03-9
- (4S,8R,9R,22S,25S,55R,56S)-7,8,18,28,29,35,55,56,58-nonahydroxy-30,54-bis(hydroxymethyl)-13,18,37,41,48,48,53,54-octamethyl-57-[(3,4,5-trihydroxyoxan-2-yl)oxy]-3,5,10,12,15,21,24,26,31,33-decaoxadecacyclo[39.9.3.2^{11,14}.2^{22,25}.1^{34,38}.0^{1,46}.0^{4,9}.0^{27,32}.0^{37,42}.0^{45,53}]octapentacont-44-ene-2,16,20-trione