Glycoside
...
GD004382

Name:
None

Formula:
C37H64O11N2

Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](O[C@@H]2C[C@@](C)(OC)[C@H](O)[C@H](C)O2)[C@H](C)[C@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@@](C)(O)C[C@H](C)N=C2O[C@@]1(C)C=C2C

Aglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)N=C2OC1(C)C=C2C

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

Other Identifiers

Properties
HBA: 13 RingCount: 4
HBD: 3 FractionCSP3: 0.89
AlogP: 3.35 Num_rotatable_bonds: 7
MolWt: 712.92 Num_heavy_atoms: 50
TPSA: 157.97 NumAromaticRings: 0

Unique Aglycone
AD03836
Formula: C29H50O8N2

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)N=C2OC1(C)C=C2C
HBA: 10 RingCount: 3
HBD: 3 FractionCSP3: 0.86
AlogP: 2.43 Num_rotatable_bonds: 4
MolWt: 554.73 Num_heavy_atoms: 39
TPSA: 130.28 NumAromaticRings: 0

Sugarmoiety
SD00005

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