Glycoside
GD158348
Name:
Venturicidin CFormula:
C43H71O10NSmiles:
CCC(=O)C(CC)C(O)C(C)CC(C)C1CC(=O)CC2(O)CC=C(C)C(O2)C(C)=CCCCC(OC2CC(OC(=N)O)C(O)C(C)O2)C=CC(C)CC1CAglycone:
CCC(=O)C(CC)C(O)C(C)CC(C)C1CC(=O)CC2(O)CC=C(C)C(O2)C(C)=CCCCC(O)C=CC(C)CC1CSugarmoiety:
CC1OC(O)CC(OC(=N)O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.79 |
| AlogP: | 7.51 | Num_rotatable_bonds: | 11 |
| MolWt: | 762.04 | Num_heavy_atoms: | 54 |
| TPSA: | 175.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD62514
Formula: C36H60O6
Smiles:
CCC(=O)C(CC)C(O)C(C)CC(C)C1CC(=O)CC2(O)CC=C(C)C(O2)C(C)=CCCCC(O)C=CC(C)CC1C| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.78 |
| AlogP: | 7.11 | Num_rotatable_bonds: | 8 |
| MolWt: | 588.87 | Num_heavy_atoms: | 42 |
| TPSA: | 104.06 | NumAromaticRings: | 0 |
