Glycoside
...
GD007030

Name:
None

Formula:
C68H124O23N4

Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](O)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)CCN(C)[C@@H]3C[C@H](C)O[C@H](O[C@@H]4[C@H](C)[C@H](O[C@@H]5C[C@@](C)(OC)[C@H](O)[C@H](C)O5)[C@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@H](C)C(=NO)[C@H](C)C[C@]4(C)OC)[C@H]3O)[C@H]2O)[C@@](C)(OC)C[C@H](C)C(=NO)[C@H](C)[C@H](O)[C@]1(C)O

Aglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CCN(C)C3CC(C)OC(OC4C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=NO)C(C)CC4(C)OC)C3O)C2O)C(C)(OC)CC(C)C(=NO)C(C)C(O)C1(C)O

Sugarmoiety:
COC1(C)CC(O)OC(C)C1O

Other Identifiers

Properties
HBA: 27 RingCount: 5
HBD: 10 FractionCSP3: 0.94
AlogP: 4.23 Num_rotatable_bonds: 16
MolWt: 1365.74 Num_heavy_atoms: 95
TPSA: 369.17 NumAromaticRings: 0

Unique Aglycone
AD05752
Formula: C60H110O20N4

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)CCN(C)C3CC(C)OC(OC4C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=NO)C(C)CC4(C)OC)C3O)C2O)C(C)(OC)CC(C)C(=NO)C(C)C(O)C1(C)O
HBA: 24 RingCount: 4
HBD: 10 FractionCSP3: 0.93
AlogP: 3.31 Num_rotatable_bonds: 13
MolWt: 1207.55 Num_heavy_atoms: 84
TPSA: 341.48 NumAromaticRings: 0

Sugarmoiety
SD00005

COC1(C)CC(O)OC(C)C1O