Glycoside
GD002860
Name:
Antibiotic Ys 822AFormula:
C37H59O14NSmiles:
CC(C)C1CCCC=CC=CC=CC=CC(OC2OC(C)C(O)C(N)C2O)CC2OC(O)(CC(O)CC(O)C(O)CCC(=O)O1)CC(O)C2C(=O)OAglycone:
CC(C)C1CCCC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)CC(O)C(O)CCC(=O)O1)CC(O)C2C(=O)OSugarmoiety:
CC1OC(O)C(O)C(N)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 3 |
| HBD: | 10 | FractionCSP3: | 0.73 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 741.87 | Num_heavy_atoms: | 52 |
| TPSA: | 258.92 | NumAromaticRings: | 0 |
Unique Aglycone
AD02677
Formula: C31H48O11
Smiles:
CC(C)C1CCCC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)CC(O)C(O)CCC(=O)O1)CC(O)C2C(=O)O| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.68 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 2 |
| MolWt: | 596.71 | Num_heavy_atoms: | 42 |
| TPSA: | 194.21 | NumAromaticRings: | 0 |
