Glycoside
...
GD149270

Name:
ahdp-mmft-4

Formula:
C51H82O32N2

Smiles:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(Oc7ccc(CC8N=C(O)C(N)C8(C)C)cc7)C(O)C6O)C(OC)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(O)C(O)C6O)C(OC)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O

Other Identifiers

Properties
HBA: 34 RingCount: 8
HBD: 20 FractionCSP3: 0.86
AlogP: -10.47 Num_rotatable_bonds: 22
MolWt: 1235.2 Num_heavy_atoms: 85
TPSA: 531.74 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
SD06966

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