Aglycone

AD12259
Formula: C90H154O39N27P3S2
Smiles:
COP(=O)(O)OP(=O)(O)OP(=O)(O)OC1CC(=O)N(CCOCCOCCOCCN2C(=O)CC(SC(NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(CC(=O)O)NC(=O)CNC(=O)C(C)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(N)=O)NC(=O)C(CCCNC(=N)N)NC(=O)C(CCCNC(=N)N)NC(=O)C(CC(C)C)NC(=O)C(C)NC(=O)C(CCCCN)NC(=O)C(CCCCN)NC(=O)CCCCC3SCC4NC(=O)NC43)C(=O)O)C2=O)C1=OHBA: | 66 | RingCount: | 4 |
HBD: | 36 | FractionCSP3: | 0.72 |
AlogP: | -8.25 | Num_rotatable_bonds: | 82 |
MolWt: | 2395.43 | Num_heavy_atoms: | 161 |
TPSA: | 1030.63 | NumAromaticRings: | 0 |