Aglycone

AD05064
Formula: C109H131O31N22Cl
Smiles:
CC(C)CC1NC(=O)CNC(=O)C(c2ccc(O)cc2)NC(=O)C(C(C)O)NC(=O)C(c2ccc(O)cc2)NC(=O)C(CCCN)NC(=O)C(Cc2ccccc2)NC(=O)C(C(C)O)NC(=O)C(c2ccc(O)cc2)NC(=O)C(c2ccc(O)cc2)NC(=O)C(C(C)C)NC(=O)C(CCCN)NC(=O)C(c2ccc(O)cc2)NC(=O)C(CNC(=O)C(CC(N)=O)NC(=O)Cc2ccccc2[N+](=O)[O-])C(C(N)=O)OC(=O)C(c2ccc(O)c(Cl)c2)NC(=O)C(C)NC1=OHBA: | 53 | RingCount: | 9 |
HBD: | 33 | FractionCSP3: | 0.37 |
AlogP: | -2.13 | Num_rotatable_bonds: | 29 |
MolWt: | 2268.81 | Num_heavy_atoms: | 162 |
TPSA: | 864.2 | NumAromaticRings: | 8 |