Glycoside
...
GD019649

Name:
None

Formula:
C46H89O12N3

Smiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](OC2CC(C)(OC)C(O)C(C)O2)[C@H](C)[C@H](OC2OC(C)CC(N(C)C)C2O)[C@@](C)(O)C[C@H](C)[C@H](NC(C)CCCN(CC)CC)[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)C)C2O)C(C)(O)CC(C)C(NC(C)CCCN(CC)CC)C(C)C(O)C1(C)O

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

Other Identifiers

Properties
HBA: 15 RingCount: 3
HBD: 6 FractionCSP3: 0.98
AlogP: 3.69 Num_rotatable_bonds: 15
MolWt: 876.23 Num_heavy_atoms: 61
TPSA: 192.11 NumAromaticRings: 0

Unique Aglycone
AD13686
Formula: C38H75O9N3

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)C(NC(C)CCCN(CC)CC)C(C)C(O)C1(C)O
HBA: 12 RingCount: 2
HBD: 6 FractionCSP3: 0.97
AlogP: 2.76 Num_rotatable_bonds: 12
MolWt: 718.03 Num_heavy_atoms: 50
TPSA: 164.42 NumAromaticRings: 0

Sugarmoiety
SD00005

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