Glycoside
...
GD014735

Name:
None

Formula:
C40H69O14N

Smiles:
CCCN1C(=O)O[C@@H]2[C@H](O[C@@H]3[C@H](C)[C@H](O[C@@H]4C[C@@](C)(OC)[C@H](O)[C@H](C)O4)[C@H](C)C(=O)O[C@H](CC)[C@@](C)(O)[C@H](O)[C@H](C)C(=O)[C@H](C)C[C@]3(C)OC)O[C@H](C)C[C@H]21

Aglycone:
CCCN1C(=O)OC2C(OC3C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C(C)CC3(C)OC)OC(C)CC21

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

Other Identifiers

Properties
HBA: 15 RingCount: 4
HBD: 3 FractionCSP3: 0.93
AlogP: 3.75 Num_rotatable_bonds: 9
MolWt: 787.99 Num_heavy_atoms: 55
TPSA: 188.98 NumAromaticRings: 0

Unique Aglycone
AD10799
Formula: C32H55O11N

Smiles:
CCCN1C(=O)OC2C(OC3C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C(=O)C(C)CC3(C)OC)OC(C)CC21
HBA: 12 RingCount: 3
HBD: 3 FractionCSP3: 0.91
AlogP: 2.82 Num_rotatable_bonds: 6
MolWt: 629.79 Num_heavy_atoms: 44
TPSA: 161.29 NumAromaticRings: 0

Sugarmoiety
SD00005

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