Glycoside

GD000312
Name:
NoneFormula:
C46H75O14NSmiles:
CC=C[C@@H]1O[C@](OC)([C@H](C)[C@H](O)[C@H](C)[C@@H]2OC(=O)C(OC)=CC(C)=C[C@H](C)[C@H](O)[C@H](C)[C@H](O)[C@H](C)CC(C)=CC=C[C@H]2OC)CC(OC2CC(O)C(OC(N)=O)C(C)O2)[C@H]1CAglycone:
CC=CC1OC(OC)(C(C)C(O)C(C)C2OC(=O)C(OC)=CC(C)=CC(C)C(O)C(C)C(O)C(C)CC(C)=CC=CC2OC)CC(O)C1CSugarmoiety:
CC1OC(O)CC(O)C1OC(N)=OOther Identifiers
Properties
HBA: | 15 | RingCount: | 3 |
HBD: | 6 | FractionCSP3: | 0.74 |
AlogP: | 5.25 | Num_rotatable_bonds: | 11 |
MolWt: | 866.1 | Num_heavy_atoms: | 61 |
TPSA: | 214.92 | NumAromaticRings: | 0 |
Unique Aglycone
AD00357
Formula: C39H64O10
Smiles:
CC=CC1OC(OC)(C(C)C(O)C(C)C2OC(=O)C(OC)=CC(C)=CC(C)C(O)C(C)C(O)C(C)CC(C)=CC=CC2OC)CC(O)C1CHBA: | 10 | RingCount: | 2 |
HBD: | 4 | FractionCSP3: | 0.72 |
AlogP: | 5.26 | Num_rotatable_bonds: | 8 |
MolWt: | 692.93 | Num_heavy_atoms: | 49 |
TPSA: | 144.14 | NumAromaticRings: | 0 |