Glycoside
GD155230
Name:
5-(7-{[3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy}-10-hydroxy-9-methoxy-3-methyl-1H,3H,4H-naphtho[2,3-c]pyran-5-yl)-10-hydroxy-7,9-dimethoxy-3-methyl-1H,3H,4H-naphtho[2,3-c]pyran-4-yl acetateFormula:
C40H46O15Smiles:
COc1cc(OC)c2c(O)c3c(c(-c4c5c(c(O)c6c(OC)cc(OC7OC(CO)C(OC)C(O)C7O)cc46)COC(C)C5)c2c1)C(OC(C)=O)C(C)OC3Aglycone:
COc1cc(OC)c2c(O)c3c(c(-c4c5c(c(O)c6c(OC)cc(O)cc46)COC(C)C5)c2c1)C(OC(C)=O)C(C)OC3Sugarmoiety:
COC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 7 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | 3.91 | Num_rotatable_bonds: | 9 |
| MolWt: | 766.79 | Num_heavy_atoms: | 55 |
| TPSA: | 201.29 | NumAromaticRings: | 4 |
Unique Aglycone
AD61586
Formula: C33H34O10
Smiles:
COc1cc(OC)c2c(O)c3c(c(-c4c5c(c(O)c6c(OC)cc(O)cc46)COC(C)C5)c2c1)C(OC(C)=O)C(C)OC3| HBA: | 10 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 5.79 | Num_rotatable_bonds: | 5 |
| MolWt: | 590.63 | Num_heavy_atoms: | 43 |
| TPSA: | 133.14 | NumAromaticRings: | 4 |
