Glycoside
GD157264
Name:
Nymphaeoside AFormula:
C27H38O12Smiles:
COc1cc(C(O)C(CO)Oc2c(OC)cc(CCCO)cc2OC)ccc1OC1OC(C)C(O)C(O)C1OAglycone:
COc1cc(C(O)C(CO)Oc2c(OC)cc(CCCO)cc2OC)ccc1OSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 13 |
| MolWt: | 554.59 | Num_heavy_atoms: | 39 |
| TPSA: | 176.76 | NumAromaticRings: | 2 |
Unique Aglycone
AD46927
Formula: C21H28O8
Smiles:
COc1cc(C(O)C(CO)Oc2c(OC)cc(CCCO)cc2OC)ccc1O| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 11 |
| MolWt: | 408.45 | Num_heavy_atoms: | 29 |
| TPSA: | 117.84 | NumAromaticRings: | 2 |
