Glycoside
...
GD136759

Name:
Landomycin C

Formula:
C55H74O21

Smiles:
Cc1cc(O)c2c(c1)CC(O)C1=C2C(=O)c2c(O)ccc(OC3CC(O)C(OC4CC(OC5CCC(OC6CCC(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=O

Aglycone:
CC1OC(O)CCC1O.CC1OC(OC2CCC(O)OC2C)CCC1O.Cc1cc(O)c2c(c1)CC(O)C1=C2C(=O)c2c(O)ccc(O)c2C1=O

Sugarmoiety:
CC1OC(OC2CC(OC3C(O)CC(O)OC3C)OC(C)C2O)CCC1O

Other Identifiers

Properties
HBA: 21 RingCount: 10
HBD: 7 FractionCSP3: 0.71
AlogP: 3.88 Num_rotatable_bonds: 12
MolWt: 1071.18 Num_heavy_atoms: 76
TPSA: 286.51 NumAromaticRings: 2

Unique Aglycone
AD00171
Formula: C6H12O3

Smiles:
CC1OC(O)CCC1O
HBA: 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
AD01640
Formula: C12H22O5

Smiles:
CC1OC(OC2CCC(O)OC2C)CCC1O
HBA: 5 RingCount: 2
HBD: 2 FractionCSP3: 1.0
AlogP: 0.77 Num_rotatable_bonds: 2
MolWt: 246.3 Num_heavy_atoms: 17
TPSA: 68.15 NumAromaticRings: 0
AD04147
Formula: C19H14O6

Smiles:
Cc1cc(O)c2c(c1)CC(O)C1=C2C(=O)c2c(O)ccc(O)c2C1=O
HBA: 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

Sugarmoiety
SD03091

CC1OC(OC2CC(OC3C(O)CC(O)OC3C)OC(C)C2O)CCC1O