Glycoside

GD154288
Name:
gahdp-mft-7Formula:
C70H113O48N3Smiles:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(OC8C(CO)OC(OC9C(CO)OC(Oc%10ccc(CC%11N=C(O)C(N=C(O)CN)C%11(C)C)cc%10)C(O)C9O)C(O)C8O)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)C1N=C(O)CNSugarmoiety:
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(OC8C(CO)OC(OC9C(CO)OC(O)C(O)C9O)C(O)C8O)C(O)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1OOther Identifiers
Properties
HBA: | 51 | RingCount: | 11 |
HBD: | 31 | FractionCSP3: | 0.89 |
AlogP: | -17.7 | Num_rotatable_bonds: | 32 |
MolWt: | 1764.65 | Num_heavy_atoms: | 121 |
TPSA: | 812.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD45135
Formula: C15H21O3N3
Smiles:
CC1(C)C(Cc2ccc(O)cc2)N=C(O)C1N=C(O)CNHBA: | 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

SD04313
COC1C(CO)OC(OC2C(CO)OC(OC3C(CO)OC(OC4C(CO)OC(OC5C(CO)OC(OC6C(CO)OC(OC7C(CO)OC(OC8C(CO)OC(OC9C(CO)OC(O)C(O)C9O)C(O)C8O)C(O)C7O)C(O)C6O)C(O)C5O)C(O)C4O)C(O)C3O)C(O)C2O)C(O)C1O