Glycoside
GD142424
Name:
2,3,4,5,6-pentakis({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})hexanalFormula:
C36H62O31Smiles:
O=CC(OC1OC(CO)C(O)C(O)C1O)C(OC1OC(CO)C(O)C(O)C1O)C(OC1OC(CO)C(O)C(O)C1O)C(COC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1OAglycone:
[empty]Sugarmoiety:
O=CC(OC1OC(CO)C(O)C(O)C1O)C(OC1OC(CO)C(O)C(O)C1O)C(OC1OC(CO)C(O)C(O)C1O)C(COC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 31 | RingCount: | 5 |
| HBD: | 20 | FractionCSP3: | 0.97 |
| AlogP: | -14.26 | Num_rotatable_bonds: | 20 |
| MolWt: | 990.86 | Num_heavy_atoms: | 67 |
| TPSA: | 513.97 | NumAromaticRings: | 0 |
Unique Aglycone
Sugarmoiety
SD08851
O=CC(OC1OC(CO)C(O)C(O)C1O)C(OC1OC(CO)C(O)C(O)C1O)C(OC1OC(CO)C(O)C(O)C1O)C(COC1OC(CO)C(O)C(O)C1O)OC1OC(CO)C(O)C(O)C1O