Aglycone

AD06723
Formula: C100H142O33N20S5
Smiles:
COc1cc2c(c(OC)c1OC)-c1ccc(OC)c(=O)cc1C(N(C(C)=O)C(=O)C(CS)NC(=O)C(CCC(=O)O)NC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)C(NC(=O)C(CNC(=O)C1CCCN1C(=O)C(CCC(=O)O)NC(=O)C(CC(N)=O)NC(=O)C(CCCCNC(=O)CCS)NC(=O)CCS)NC(=O)C1CCCN1C(=O)C(CCC(=O)O)NC(=O)C(CC(N)=O)NC(=O)C(CCCCNC(=O)CCS)NC(=O)CCS)C(C)O)CC2HBA: | 53 | RingCount: | 6 |
HBD: | 23 | FractionCSP3: | 0.57 |
AlogP: | -4.59 | Num_rotatable_bonds: | 68 |
MolWt: | 2312.68 | Num_heavy_atoms: | 158 |
TPSA: | 786.8 | NumAromaticRings: | 3 |