Glycoside
GD130524
Name:
Platensimycin_B4Formula:
C32H43O12NSmiles:
CC1C2CC3CC1(C=CC(=O)C(C)(C)CCC(O)=Nc1c(OC4OC(CO)C(O)C(O)C4O)ccc(C(=O)O)c1O)CC3(C)O2Aglycone:
CC1C2CC3CC1(C=CC(=O)C(C)(C)CCC(O)=Nc1c(O)ccc(C(=O)O)c1O)CC3(C)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.66 |
| AlogP: | 2.38 | Num_rotatable_bonds: | 11 |
| MolWt: | 633.69 | Num_heavy_atoms: | 45 |
| TPSA: | 215.8 | NumAromaticRings: | 1 |
Unique Aglycone
AD52893
Formula: C26H33O7N
Smiles:
CC1C2CC3CC1(C=CC(=O)C(C)(C)CCC(O)=Nc1c(O)ccc(C(=O)O)c1O)CC3(C)O2| HBA: | 8 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.58 |
| AlogP: | 4.91 | Num_rotatable_bonds: | 8 |
| MolWt: | 471.55 | Num_heavy_atoms: | 34 |
| TPSA: | 136.65 | NumAromaticRings: | 1 |
