Glycoside
...
GD119073

Name:
ahdp-mmft-3

Formula:
C45H72O27N2

Smiles:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(Oc6ccc(CC7N=C(O)C(N)C7(C)C)cc6)C(O)C5O)C(OC)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Aglycone:
CC1(C)C(Cc2ccc(O)cc2)N=C(O)C1N

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: 0.84
AlogP: -8.3 Num_rotatable_bonds: 19
MolWt: 1073.06 Num_heavy_atoms: 74
TPSA: 452.59 NumAromaticRings: 1

Unique Aglycone
AD44967
Formula: C13H18O2N2

Smiles:
CC1(C)C(Cc2ccc(O)cc2)N=C(O)C1N
HBA: 4 RingCount: 2
HBD: 4 FractionCSP3: 0.46
AlogP: 1.63 Num_rotatable_bonds: 2
MolWt: 234.3 Num_heavy_atoms: 17
TPSA: 78.84 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