Glycoside

GD016287
Name:
NoneFormula:
C39H65O15NSmiles:
CC[C@@H]1OC(=O)[C@H](C)[C@H](OC2C[C@@](C)(OC)[C@H](O)[C@H](C)O2)[C@H](C)[C@H](OC2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@]2(C)C[C@H](C)[C@H](OC(=O)O2)[C@H](C)[C@@H]2OC(=O)O[C@]12CAglycone:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C2(C)CC(C)C(OC(=O)O2)C(C)C2OC(=O)OC12CSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
HBA: | 16 | RingCount: | 5 |
HBD: | 2 | FractionCSP3: | 0.92 |
AlogP: | 3.94 | Num_rotatable_bonds: | 7 |
MolWt: | 787.94 | Num_heavy_atoms: | 55 |
TPSA: | 187.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD11751
Formula: C31H51O12N
Smiles:
CCC1OC(=O)C(C)C(O)C(C)C(OC2OC(C)CC(N(C)C)C2O)C2(C)CC(C)C(OC(=O)O2)C(C)C2OC(=O)OC12CHBA: | 13 | RingCount: | 4 |
HBD: | 2 | FractionCSP3: | 0.9 |
AlogP: | 3.02 | Num_rotatable_bonds: | 4 |
MolWt: | 629.74 | Num_heavy_atoms: | 44 |
TPSA: | 159.52 | NumAromaticRings: | 0 |