Aglycone

AD18748
Formula: C99H123O26N25S2
Smiles:
C=C1CC(C2OCCN2C(=O)OCCSSCC(NC(=O)C(CCC(=O)NC)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)NC)NC(=O)C(CCC(=O)O)NC(=O)C(CCC(=O)NC)NC(=O)CCC(NC(=O)c2ccc(NCc3cnc4nc(N)[nH]c(=O)c4n3)cc2)C(=O)O)C(=O)O)N(C(=O)c2cc(OC)c(OCCCCCOc3ccc(-c4nc5ccc(-c6nc7cc(N8CCN(C)CC8)ccc7[nH]6)cc5[nH]4)cc3)cc2N)C1HBA: | 51 | RingCount: | 12 |
HBD: | 22 | FractionCSP3: | 0.43 |
AlogP: | 2.88 | Num_rotatable_bonds: | 56 |
MolWt: | 2143.36 | Num_heavy_atoms: | 152 |
TPSA: | 726.41 | NumAromaticRings: | 9 |