Glycoside
GD156047
Name:
Neurosporaxanthin Beta-D-GlucopyranosideFormula:
C41H56O7Smiles:
CC(C=CC=C(C)C=CC=C(C)C(=O)OC1OC(CO)C(O)C(O)C1O)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)CAglycone:
CC(C=CC=C(C)C=CC=C(C)C(=O)O)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | 7.37 | Num_rotatable_bonds: | 13 |
| MolWt: | 660.89 | Num_heavy_atoms: | 48 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD61828
Formula: C35H46O2
Smiles:
CC(C=CC=C(C)C=CC=C(C)C(=O)O)=CC=CC=C(C)C=CC=C(C)C=CC1=C(C)CCCC1(C)C| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.34 |
| AlogP: | 10.11 | Num_rotatable_bonds: | 11 |
| MolWt: | 498.75 | Num_heavy_atoms: | 37 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
