Glycoside
...
GD147207

Name:
ahdp-mmft-6

Formula:
C63H102O42N2

Smiles:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(OC8C(CO)OC(Oc9ccc(CC%10N=C(O)C(N)C%10(C)C)cc9)C(O)C8O)C(OC)C7O)C(O)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

Sugarmoiety:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(OC8C(CO)OC(O)C(O)C8O)C(OC)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 44 RingCount: 10
HBD: 26 FractionCSP3: 0.89
AlogP: -14.82 Num_rotatable_bonds: 28
MolWt: 1559.48 Num_heavy_atoms: 107
TPSA: 690.04 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
SD04947

COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(OC8C(CO)OC(O)C(O)C8O)C(OC)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O