Glycoside
GD017268
Name:
4,5-dihydroxy-2-{[1-hydroxy-3,8-dimethyl-5-(6-methylhept-5-en-2-yl)-5,6,7,8-tetrahydronaphthalen-2-yl]oxy}oxan-3-yl acetateFormula:
C27H40O7Smiles:
CC(=O)O[C@@H]1[C@H](Oc2c(C)cc3c(c2O)[C@H](C)CC[C@H]3[C@H](C)CCC=C(C)C)OC[C@H](O)[C@H]1OAglycone:
CC(C)=CCCC(C)C1CCC(C)c2c1cc(C)c(O)c2OSugarmoiety:
CC(=O)OC1C(O)OCC(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | 4.45 | Num_rotatable_bonds: | 7 |
| MolWt: | 476.61 | Num_heavy_atoms: | 34 |
| TPSA: | 105.45 | NumAromaticRings: | 1 |
Unique Aglycone
AD02046
Formula: C20H30O2
Smiles:
CC(C)=CCCC(C)C1CCC(C)c2c1cc(C)c(O)c2O| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | 5.77 | Num_rotatable_bonds: | 4 |
| MolWt: | 302.46 | Num_heavy_atoms: | 22 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
