Glycoside
GD125381
Name:
7-O-(Α-Glucosyl)-Cineromycin BFormula:
C23H36O9Smiles:
CC1=CCCC(C)C(C)OC(=O)C=CC(C)(O)C=CC1OC1OC(CO)C(O)C(O)C1OAglycone:
CC1=CCCC(C)C(C)OC(=O)C=CC(C)(O)C=CC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.7 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 3 |
| MolWt: | 456.53 | Num_heavy_atoms: | 32 |
| TPSA: | 145.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD50704
Formula: C17H26O4
Smiles:
CC1=CCCC(C)C(C)OC(=O)C=CC(C)(O)C=CC1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.59 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 0 |
| MolWt: | 294.39 | Num_heavy_atoms: | 21 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
