Glycoside

GD029341
Name:
NoneFormula:
C23H30O10N3PSmiles:
C=CCO[C@@H]1[C@H](O)[C@H](COP(=O)(NC(C)C(=O)OCC)Oc2ccccc2)O[C@H]1n1ccc(=O)[nH]c1=OAglycone:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1.O=c1cc[nH]c(=O)[nH]1Sugarmoiety:
C=CCOC1C(O)OC(O)C1OOther Identifiers
Properties
HBA: | 13 | RingCount: | 3 |
HBD: | 3 | FractionCSP3: | 0.43 |
AlogP: | 1.11 | Num_rotatable_bonds: | 13 |
MolWt: | 539.48 | Num_heavy_atoms: | 37 |
TPSA: | 167.41 | NumAromaticRings: | 2 |
Unique Aglycone
AD00106
Formula: C4H4O2N2
Smiles:
O=c1cc[nH]c(=O)[nH]1HBA: | 4 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 0.0 |
AlogP: | -0.94 | Num_rotatable_bonds: | 0 |
MolWt: | 112.09 | Num_heavy_atoms: | 8 |
TPSA: | 65.72 | NumAromaticRings: | 1 |
AD00514
Formula: C12H18O5NP
Smiles:
CCOC(=O)C(C)NP(=O)(OC)Oc1ccccc1HBA: | 6 | RingCount: | 1 |
HBD: | 1 | FractionCSP3: | 0.42 |
AlogP: | 2.36 | Num_rotatable_bonds: | 7 |
MolWt: | 287.25 | Num_heavy_atoms: | 19 |
TPSA: | 73.86 | NumAromaticRings: | 1 |