Glycoside

GD022583
Name:
NoneFormula:
C37H34O10N4Smiles:
Cc1cc(O)c2c(c1)C1OC(=O)[C@H](COCc3cn(Cc4ccccc4)nn3)N1C1=C2C(=O)c2cccc(O[C@@H]3C[C@H](O)[C@H](O)[C@H](C)O3)c2C1=OAglycone:
Cc1cc(O)c2c(c1)C1OC(=O)C(COCc3cn(Cc4ccccc4)nn3)N1C1=C2C(=O)c2cccc(O)c2C1=OSugarmoiety:
CC1OC(O)CC(O)C1OOther Identifiers
Properties
HBA: | 14 | RingCount: | 8 |
HBD: | 3 | FractionCSP3: | 0.32 |
AlogP: | 2.82 | Num_rotatable_bonds: | 8 |
MolWt: | 694.7 | Num_heavy_atoms: | 51 |
TPSA: | 182.77 | NumAromaticRings: | 4 |
Unique Aglycone
AD15293
Formula: C31H24O7N4
Smiles:
Cc1cc(O)c2c(c1)C1OC(=O)C(COCc3cn(Cc4ccccc4)nn3)N1C1=C2C(=O)c2cccc(O)c2C1=OHBA: | 11 | RingCount: | 7 |
HBD: | 2 | FractionCSP3: | 0.19 |
AlogP: | 3.29 | Num_rotatable_bonds: | 6 |
MolWt: | 564.55 | Num_heavy_atoms: | 42 |
TPSA: | 144.08 | NumAromaticRings: | 4 |