Glycoside
GD142728
Name:
3,4-Didehydro-1-(Beta-D-Glucopyranosyloxy)-1,2-Dihydro-Psi,Psi-CaroteneFormula:
C46H66O6Smiles:
CC(C)=CCCC(C)=CC=CC(C)=CC=CC(C)=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)=CCCC(C)=CC=CC(C)=CC=CC(C)=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: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 9.73 | Num_rotatable_bonds: | 19 |
| MolWt: | 715.03 | Num_heavy_atoms: | 52 |
| TPSA: | 99.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD56319
Formula: C40H56O
Smiles:
CC(C)=CCCC(C)=CC=CC(C)=CC=CC(C)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.35 |
| AlogP: | 11.91 | Num_rotatable_bonds: | 16 |
| MolWt: | 552.89 | Num_heavy_atoms: | 41 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
