Glycoside

GD007766
Name:
NoneFormula:
C31H37O15PSmiles:
CCOP(=O)(OCC)O[C@@]1(C)C(=O)c2cc3c(c(O)c2[C@H](OC2OC(C)C(O)C(O)C2OC)[C@H]1OC)C(=O)c1c(O)cccc1C3=OAglycone:
CCOP(=O)(OCC)OC1(C)C(=O)c2cc3c(c(O)c2C(O)C1OC)C(=O)c1c(O)cccc1C3=OSugarmoiety:
COC1C(O)OC(C)C(O)C1OOther Identifiers
Properties
HBA: | 15 | RingCount: | 5 |
HBD: | 4 | FractionCSP3: | 0.52 |
AlogP: | 2.58 | Num_rotatable_bonds: | 10 |
MolWt: | 680.6 | Num_heavy_atoms: | 47 |
TPSA: | 213.81 | NumAromaticRings: | 2 |
Unique Aglycone
AD06291
Formula: C24H25O11P
Smiles:
CCOP(=O)(OCC)OC1(C)C(=O)c2cc3c(c(O)c2C(O)C1OC)C(=O)c1c(O)cccc1C3=OHBA: | 11 | RingCount: | 4 |
HBD: | 3 | FractionCSP3: | 0.38 |
AlogP: | 3.07 | Num_rotatable_bonds: | 7 |
MolWt: | 520.43 | Num_heavy_atoms: | 36 |
TPSA: | 165.89 | NumAromaticRings: | 2 |