Glycoside
GD136102
Name:
2-{[4,5-dihydroxy-2-({5-[2-hydroxy-5-(hydroxymethyl)-2,5,8a-trimethyl-decahydronaphthalen-1-yl]-3-methylpent-1-en-3-yl}oxy)-6-methyloxan-3-yl]oxy}-6-methyloxane-3,4,5-triolFormula:
C32H56O11Smiles:
C=CC(C)(CCC1C(C)(O)CCC2C(C)(CO)CCCC12C)OC1OC(C)C(O)C(O)C1OC1OC(C)C(O)C(O)C1OAglycone:
C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(CO)CCCC12CSugarmoiety:
CC1OC(OC2C(O)OC(C)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.94 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 9 |
| MolWt: | 616.79 | Num_heavy_atoms: | 43 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD53590
Formula: C20H36O3
Smiles:
C=CC(C)(O)CCC1C(C)(O)CCC2C(C)(CO)CCCC12C| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.9 |
| AlogP: | 3.67 | Num_rotatable_bonds: | 5 |
| MolWt: | 324.51 | Num_heavy_atoms: | 23 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
