Glycoside
...
GD130158

Name:
mfth2-mmft-3

Formula:
C45H71O28N

Smiles:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(Oc6ccc(CC7NC(O)=C(O)C7(C)C)cc6)C(O)C5O)C(OC)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Aglycone:
CC1(C)C(O)=C(O)NC1Cc1ccc(O)cc1

Sugarmoiety:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(O)C(O)C5O)C(OC)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 29 RingCount: 7
HBD: 17 FractionCSP3: 0.82
AlogP: -7.7 Num_rotatable_bonds: 19
MolWt: 1074.04 Num_heavy_atoms: 74
TPSA: 446.47 NumAromaticRings: 1

Unique Aglycone
AD45068
Formula: C13H17O3N

Smiles:
CC1(C)C(O)=C(O)NC1Cc1ccc(O)cc1
HBA: 4 RingCount: 2
HBD: 4 FractionCSP3: 0.38
AlogP: 2.22 Num_rotatable_bonds: 2
MolWt: 235.28 Num_heavy_atoms: 17
TPSA: 72.72 NumAromaticRings: 1

Sugarmoiety
SD05368

COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(O)C(O)C5O)C(OC)C4O)C(O)C3O)C(O)C2O)C(O)C1O