Glycoside

GD144049
Name:
ahdp-mft-5Formula:
C56H90O37N2Smiles:
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)C9(C)C)cc8)C(O)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1OAglycone:
CC1(C)C(Cc2ccc(O)cc2)N=C(O)C1NSugarmoiety:
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(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1OOther Identifiers
Properties
HBA: | 39 | RingCount: | 9 |
HBD: | 24 | FractionCSP3: | 0.88 |
AlogP: | -13.3 | Num_rotatable_bonds: | 24 |
MolWt: | 1383.31 | Num_heavy_atoms: | 95 |
TPSA: | 621.89 | NumAromaticRings: | 1 |
Unique Aglycone
AD44967
Formula: C13H18O2N2
Smiles:
CC1(C)C(Cc2ccc(O)cc2)N=C(O)C1NHBA: | 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

SD06331
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(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O