Glycoside
GD132255
Name:
Tjipanazole C1Formula:
C25H21O4N2ClSmiles:
CC1OC(n2c3ccc(Cl)cc3c3ccc4c5ccccc5[nH]c4c32)C(O)C(O)C1OAglycone:
Clc1ccc2[nH]c3c(ccc4c5ccccc5[nH]c43)c2c1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.25 |
| AlogP: | 4.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 436.9 | Num_heavy_atoms: | 31 |
| TPSA: | 90.64 | NumAromaticRings: | 5 |
Unique Aglycone
AD53537
Formula: C19H11N2Cl
Smiles:
Clc1ccc2[nH]c3c(ccc4c5ccccc5[nH]c43)c2c1| HBA: | 2 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 5.61 | Num_rotatable_bonds: | 0 |
| MolWt: | 290.75 | Num_heavy_atoms: | 21 |
| TPSA: | 31.58 | NumAromaticRings: | 5 |
