Glycoside
...
GD007727

Name:
None

Formula:
C47H89O13N5S

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)CN(CCCNC(=S)NCCN2CCOCC2)[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)CN(CCCNC(=S)NCCN2CCOCC2)C(C)C(O)C1(C)O

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

Other Identifiers

Properties
HBA: 18 RingCount: 4
HBD: 7 FractionCSP3: 0.96
AlogP: 1.46 Num_rotatable_bonds: 14
MolWt: 964.32 Num_heavy_atoms: 66
TPSA: 216.61 NumAromaticRings: 0

Unique Aglycone
AD06262
Formula: C39H75O10N5S

Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C(C)(O)CC(C)CN(CCCNC(=S)NCCN2CCOCC2)C(C)C(O)C1(C)O
HBA: 15 RingCount: 3
HBD: 7 FractionCSP3: 0.95
AlogP: 0.53 Num_rotatable_bonds: 11
MolWt: 806.12 Num_heavy_atoms: 55
TPSA: 188.92 NumAromaticRings: 0

Sugarmoiety
SD00005

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