Glycoside
GD118672
Name:
d-olivosyl-jadomycin-asnFormula:
C29H28O10N2Smiles:
Cc1cc(O)c2c(c1)C1OC(=O)C(CCC(=N)O)N1C1=C2C(=O)c2cccc(OC3CC(O)C(O)C(C)O3)c2C1=OAglycone:
Cc1cc(O)c2c(c1)C1OC(=O)C(CCC(=N)O)N1C1=C2C(=O)c2cccc(O)c2C1=OSugarmoiety:
CC1OC(O)CC(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 564.55 | Num_heavy_atoms: | 41 |
| TPSA: | 186.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD47475
Formula: C23H18O7N2
Smiles:
Cc1cc(O)c2c(c1)C1OC(=O)C(CCC(=N)O)N1C1=C2C(=O)c2cccc(O)c2C1=O| HBA: | 9 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.22 |
| AlogP: | 2.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 434.4 | Num_heavy_atoms: | 32 |
| TPSA: | 148.22 | NumAromaticRings: | 2 |
