Glycoside
GD143677
Name:
6-({4,12-dimethoxy-17-methyl-13-oxo-17-azatetracyclo[7.5.3.0¹,¹â°.0²,â·]heptadeca-2,4,6,11-tetraen-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acidFormula:
C25H31O10NSmiles:
COC1=CC2C3Cc4ccc(OC)c(OC5OC(C(=O)O)C(O)C(O)C5O)c4C2(CCN3C)CC1=OAglycone:
COC1=CC2C3Cc4ccc(OC)c(O)c4C2(CCN3C)CC1=OSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.6 |
| AlogP: | -0.42 | Num_rotatable_bonds: | 5 |
| MolWt: | 505.52 | Num_heavy_atoms: | 36 |
| TPSA: | 155.22 | NumAromaticRings: | 1 |
Unique Aglycone
AD57773
Formula: C19H23O4N
Smiles:
COC1=CC2C3Cc4ccc(OC)c(O)c4C2(CCN3C)CC1=O| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.53 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 2 |
| MolWt: | 329.4 | Num_heavy_atoms: | 24 |
| TPSA: | 59.0 | NumAromaticRings: | 1 |
