Glycoside
...
GD145108

Name:
gahdp-mmft-5

Formula:
C59H95O38N3

Smiles:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(Oc8ccc(CC9N=C(O)C(N=C(O)CN)C9(C)C)cc8)C(O)C7O)C(OC)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O

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

Sugarmoiety:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(O)C(O)C7O)C(OC)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 41 RingCount: 9
HBD: 24 FractionCSP3: 0.86
AlogP: -12.69 Num_rotatable_bonds: 27
MolWt: 1454.39 Num_heavy_atoms: 100
TPSA: 643.48 NumAromaticRings: 1

Unique Aglycone
AD45135
Formula: C15H21O3N3

Smiles:
CC1(C)C(Cc2ccc(O)cc2)N=C(O)C1N=C(O)CN
HBA: 6 RingCount: 2
HBD: 5 FractionCSP3: 0.47
AlogP: 1.58 Num_rotatable_bonds: 4
MolWt: 291.35 Num_heavy_atoms: 21
TPSA: 111.43 NumAromaticRings: 1

Sugarmoiety
SD05608

COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(O)C(O)C7O)C(OC)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O