Glycoside

GD008144
Name:
NoneFormula:
C18H21O9PSmiles:
O=P(O)(O)OC[C@@H]1O[C@H](Oc2ccc(-c3ccccc3)cc2)[C@H](O)[C@H](O)[C@H]1OAglycone:
COP(=O)(O)O.Oc1ccc(-c2ccccc2)cc1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 9 | RingCount: | 3 |
HBD: | 5 | FractionCSP3: | 0.33 |
AlogP: | 0.65 | Num_rotatable_bonds: | 6 |
MolWt: | 412.33 | Num_heavy_atoms: | 28 |
TPSA: | 145.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)OHBA: | 4 | RingCount: | 0 |
HBD: | 2 | FractionCSP3: | 1.0 |
AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
MolWt: | 112.02 | Num_heavy_atoms: | 6 |
TPSA: | 66.76 | NumAromaticRings: | 0 |
AD03225
Formula: C12H10O
Smiles:
Oc1ccc(-c2ccccc2)cc1HBA: | 1 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.0 |
AlogP: | 3.06 | Num_rotatable_bonds: | 1 |
MolWt: | 170.21 | Num_heavy_atoms: | 13 |
TPSA: | 20.23 | NumAromaticRings: | 2 |