Glycoside
GD127755
Name:
N-{4-[(4-hydroxyphenyl)formamido]butyl}-3-{3-methoxy-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]phenyl}prop-2-enamideFormula:
C27H34O9N2Smiles:
COc1cc(C=CC(O)=NCCCCNC(=O)c2ccc(O)cc2)ccc1OC1OC(C)C(O)C(O)C1OAglycone:
COc1cc(C=CC(O)=NCCCCNC(=O)c2ccc(O)cc2)ccc1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.41 |
| AlogP: | 1.79 | Num_rotatable_bonds: | 11 |
| MolWt: | 530.57 | Num_heavy_atoms: | 38 |
| TPSA: | 170.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD51745
Formula: C21H24O5N2
Smiles:
COc1cc(C=CC(O)=NCCCCNC(=O)c2ccc(O)cc2)ccc1O| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.24 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 9 |
| MolWt: | 384.43 | Num_heavy_atoms: | 28 |
| TPSA: | 111.38 | NumAromaticRings: | 2 |
