Glycoside
GD157738
Name:
Cystomanamide CFormula:
C34H54O14N6Smiles:
CC(C)CCCCCC(CC(O)=NC(CC(=N)O)C(O)=NC(C(O)=NC(C(=O)O)C(O)c1ccccc1)C(O)C(=N)O)NCC1(O)OCC(O)C(O)C1OAglycone:
CNC(CCCCCC(C)C)CC(O)=NC(CC(=N)O)C(O)=NC(C(O)=NC(C(=O)O)C(O)c1ccccc1)C(O)C(=N)OSugarmoiety:
OC1COC(O)(O)C(O)C1OOther Identifiers
Properties
| HBA: | 20 | RingCount: | 2 |
| HBD: | 15 | FractionCSP3: | 0.65 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 23 |
| MolWt: | 770.83 | Num_heavy_atoms: | 54 |
| TPSA: | 365.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD62335
Formula: C29H46O9N6
Smiles:
CNC(CCCCCC(C)C)CC(O)=NC(CC(=N)O)C(O)=NC(C(O)=NC(C(=O)O)C(O)c1ccccc1)C(O)C(=N)O| HBA: | 15 | RingCount: | 1 |
| HBD: | 11 | FractionCSP3: | 0.59 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 21 |
| MolWt: | 622.72 | Num_heavy_atoms: | 44 |
| TPSA: | 275.72 | NumAromaticRings: | 1 |
