Glycoside

GD004798
Name:
Landomycin AFormula:
C55H74O22Smiles:
Cc1cc(O)c2c(c1)C[C@H](O)C1=C2C(=O)c2c(O)ccc(OC3CC(O)C(OC4CC(OC5CCC(OC6CC(O)C(OC7CC(OC8CCC(O)C(C)O8)C(O)C(C)O7)C(C)O6)C(C)O5)C(O)C(C)O4)C(C)O3)c2C1=OAglycone:
CC1OC(O)CCC1O.CC1OC(O)CCC1O.Cc1cc(O)c2c(c1)CC(O)C1=C2C(=O)c2c(O)ccc(O)c2C1=OSugarmoiety:
CC1OC(OC2CC(OC3C(O)CC(O)OC3C)OC(C)C2O)CCC1OC1CC(O)C(O)C(C)O1Other Identifiers
Properties
HBA: | 22 | RingCount: | 10 |
HBD: | 8 | FractionCSP3: | 0.71 |
AlogP: | 2.85 | Num_rotatable_bonds: | 12 |
MolWt: | 1087.18 | Num_heavy_atoms: | 77 |
TPSA: | 306.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD00171
Formula: C6H12O3
Smiles:
CC1OC(O)CCC1OHBA: | 3 | RingCount: | 1 |
HBD: | 2 | FractionCSP3: | 1.0 |
AlogP: | -0.14 | Num_rotatable_bonds: | 0 |
MolWt: | 132.16 | Num_heavy_atoms: | 9 |
TPSA: | 49.69 | NumAromaticRings: | 0 |
AD04147
Formula: C19H14O6
Smiles:
Cc1cc(O)c2c(c1)CC(O)C1=C2C(=O)c2c(O)ccc(O)c2C1=OHBA: | 6 | RingCount: | 4 |
HBD: | 4 | FractionCSP3: | 0.16 |
AlogP: | 1.86 | Num_rotatable_bonds: | 0 |
MolWt: | 338.32 | Num_heavy_atoms: | 25 |
TPSA: | 115.06 | NumAromaticRings: | 2 |