Glycoside
GD148334
Name:
Didemethylspirilloxanthin GlucosideFormula:
C46H66O7Smiles:
CC(C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)OC1OC(CO)C(O)C(O)C1OAglycone:
CC(C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 8.7 | Num_rotatable_bonds: | 19 |
| MolWt: | 731.03 | Num_heavy_atoms: | 53 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD48271
Formula: C40H56O2
Smiles:
CC(C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.35 |
| AlogP: | 10.88 | Num_rotatable_bonds: | 16 |
| MolWt: | 568.89 | Num_heavy_atoms: | 42 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
