Glycoside
GD038233
Name:
(~{z})-~{n}-[2-[(2~{r},3~{r},4~{r},5~{r},6~{r})-6-(hydroxymethyl)-3,4,5-tris(oxidanyl)oxan-2-yl]ethyl]-3-(3,4,5-trimethoxyphenyl)prop-2-enamideFormula:
C20H29O9NSmiles:
COc1cc(C=CC(=O)NCC[C@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc(OC)c1OCAglycone:
CCNC(=O)C=Cc1cc(OC)c(OC)c(OC)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 9 |
| MolWt: | 427.45 | Num_heavy_atoms: | 30 |
| TPSA: | 146.94 | NumAromaticRings: | 1 |
Unique Aglycone
AD23923
Formula: C14H19O4N
Smiles:
CCNC(=O)C=Cc1cc(OC)c(OC)c(OC)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 1.86 | Num_rotatable_bonds: | 6 |
| MolWt: | 265.31 | Num_heavy_atoms: | 19 |
| TPSA: | 56.79 | NumAromaticRings: | 1 |
