Glycoside
GD116784
Name:
delphinidin 3-arabinosideFormula:
C20H21O11Smiles:
Oc1cc(C2Oc3cc([OH2+])cc(O)c3C=C2OC2OCC(O)C(O)C2O)cc(O)c1OAglycone:
OC1=Cc2c(O)cc([OH2+])cc2OC1c1cc(O)c(O)c(O)c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.3 |
| AlogP: | -0.12 | Num_rotatable_bonds: | 3 |
| MolWt: | 437.38 | Num_heavy_atoms: | 31 |
| TPSA: | 192.2 | NumAromaticRings: | 2 |
Unique Aglycone
AD45257
Formula: C15H13O7
Smiles:
OC1=Cc2c(O)cc([OH2+])cc2OC1c1cc(O)c(O)c(O)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.07 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 1 |
| MolWt: | 305.26 | Num_heavy_atoms: | 22 |
| TPSA: | 133.28 | NumAromaticRings: | 2 |
