Glycoside
GD132361
Name:
2-({5-[3-({4,5-dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)-3-methylpent-4-en-1-yl]-6-hydroxy-1,4a,6-trimethyl-decahydronaphthalen-1-yl}methoxy)-6-methyloxane-3,4,5-triolFormula:
C38H66O15Smiles:
C=CC(C)(CCC1C(C)(O)CCC2C(C)(COC3OC(C)C(O)C(O)C3O)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(O)C(O)C(O)C1O.CC1OC(OC2C(O)OC(C)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.95 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 11 |
| MolWt: | 762.93 | Num_heavy_atoms: | 53 |
| TPSA: | 237.45 | 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 |
