Glycoside
GD151048
Name:
10-hydroxy-5,10-dimethyl-5-[4-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)pent-4-en-1-yl]tricyclo[7.2.1.0¹,â¶]dodecan-4-oneFormula:
C26H42O8Smiles:
C=C(CCCC1(C)C(=O)CCC23CC(CCC21)C(C)(O)C3)COC1OC(CO)C(O)C(O)C1OAglycone:
C=C(CO)CCCC1(C)C(=O)CCC23CC(CCC21)C(C)(O)C3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 8 |
| MolWt: | 482.61 | Num_heavy_atoms: | 34 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD60282
Formula: C20H32O3
Smiles:
C=C(CO)CCCC1(C)C(=O)CCC23CC(CCC21)C(C)(O)C3| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.85 |
| AlogP: | 3.63 | Num_rotatable_bonds: | 5 |
| MolWt: | 320.47 | Num_heavy_atoms: | 23 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
