Glycoside
GD114982
Name:
2-(3,4-dihydroxyphenyl)-3-[(3,4,5-trihydroxy-2,3,4,5,6,6-hexamethyloxan-2-yl)oxy]-4H-chromene-4,5,7-triolFormula:
C26H32O11Smiles:
CC1(C)OC(C)(OC2=C(c3ccc(O)c(O)c3)Oc3cc(O)cc(O)c3C2O)C(C)(O)C(C)(O)C1(C)OAglycone:
OC1=C(c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c2C1OSugarmoiety:
CC1(C)OC(C)(O)C(C)(O)C(C)(O)C1(C)OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.46 |
| AlogP: | 2.1 | Num_rotatable_bonds: | 3 |
| MolWt: | 520.53 | Num_heavy_atoms: | 37 |
| TPSA: | 189.53 | NumAromaticRings: | 2 |
Unique Aglycone
AD45397
Formula: C15H12O7
Smiles:
OC1=C(c2ccc(O)c(O)c2)Oc2cc(O)cc(O)c2C1O| HBA: | 7 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 1 |
| MolWt: | 304.25 | Num_heavy_atoms: | 22 |
| TPSA: | 130.61 | NumAromaticRings: | 2 |
