Aglycone

AD04084
Formula: C69H111O25N19
Smiles:
CCC(C)C(NCC(=O)O)C(=O)NC(C)C(=O)NC(C)CNCC(=O)NCC(=O)NC(Cc1ccccc1)C(=O)NC(CCC(O)CN)C(=O)NCC(=O)NC(CCC(=O)O)C(=O)NC(CCC(N)=O)C(=O)NCC(=O)N1CCCC1C(=O)NC(CCCCN)C(=O)NCC(=O)NC(CCC(=O)O)C(=O)NC(C(=O)O)C(C)OHBA: | 44 | RingCount: | 2 |
HBD: | 27 | FractionCSP3: | 0.64 |
AlogP: | -9.54 | Num_rotatable_bonds: | 56 |
MolWt: | 1606.76 | Num_heavy_atoms: | 113 |
TPSA: | 707.46 | NumAromaticRings: | 1 |