Glycoside
GD136763
Name:
2,8-dimethyl-8-[2-(methylamino)ethyl]-7-[(2,3,4,5,6-pentahydroxyhexyl)peroxy]-4H,6H,7H,8H-pyrano[3,2-g]chromen-4-oneFormula:
C23H33O10NSmiles:
CNCCC1(C)Oc2cc3oc(C)cc(=O)c3cc2CC1OOCC(O)C(O)C(O)C(O)COAglycone:
CNCCC1(C)Oc2cc3oc(C)cc(=O)c3cc2CC1OSugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.61 |
| AlogP: | -0.84 | Num_rotatable_bonds: | 11 |
| MolWt: | 483.51 | Num_heavy_atoms: | 34 |
| TPSA: | 171.08 | NumAromaticRings: | 2 |
Unique Aglycone
AD51713
Formula: C17H21O4N
Smiles:
CNCCC1(C)Oc2cc3oc(C)cc(=O)c3cc2CC1O| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.47 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 3 |
| MolWt: | 303.36 | Num_heavy_atoms: | 22 |
| TPSA: | 71.7 | NumAromaticRings: | 2 |
