Glycoside
GD140054
Name:
ChrymutasinFormula:
C33H33O13NSmiles:
COC1C(O)C(C)OC(OC2C(Oc3cccc4c(O)c5c(=N)c(=O)c6ccc(C)c7c(=O)oc(c34)c5c67)OC(C)C(O)C2O)C1OAglycone:
Cc1ccc2c(=O)c(=N)c3c(O)c4cccc(O)c4c4oc(=O)c1c2c34Sugarmoiety:
COC1C(O)C(C)OC(OC2C(O)OC(C)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 7 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 5 |
| MolWt: | 651.62 | Num_heavy_atoms: | 47 |
| TPSA: | 218.43 | NumAromaticRings: | 5 |
Unique Aglycone
AD56468
Formula: C20H11O5N
Smiles:
Cc1ccc2c(=O)c(=N)c3c(O)c4cccc(O)c4c4oc(=O)c1c2c34| HBA: | 6 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.05 |
| AlogP: | 2.69 | Num_rotatable_bonds: | 0 |
| MolWt: | 345.31 | Num_heavy_atoms: | 26 |
| TPSA: | 111.59 | NumAromaticRings: | 5 |
