Glycoside
GD146274
Name:
NoneFormula:
C34H43O11N3Smiles:
CCc1c2cc[nH]c2cn1-c1c2c(cc3c(=O)cc(C)oc13)CC(OOCC(O)C(O)C(O)C(O)CO)C(C)(CCC1CN=C(O)C1)O2Aglycone:
CCc1c2cc[nH]c2cn1-c1c2c(cc3c(=O)cc(C)oc13)CC(O)C(C)(CCC1CN=C(O)C1)O2Sugarmoiety:
OCC(O)C(O)C(O)C(O)COOOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.53 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 13 |
| MolWt: | 669.73 | Num_heavy_atoms: | 48 |
| TPSA: | 212.36 | NumAromaticRings: | 4 |
Unique Aglycone
AD48785
Formula: C28H31O5N3
Smiles:
CCc1c2cc[nH]c2cn1-c1c2c(cc3c(=O)cc(C)oc13)CC(O)C(C)(CCC1CN=C(O)C1)O2| HBA: | 8 | RingCount: | 6 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 4.75 | Num_rotatable_bonds: | 5 |
| MolWt: | 489.57 | Num_heavy_atoms: | 36 |
| TPSA: | 112.98 | NumAromaticRings: | 4 |
