Glycoside
GD127590
Name:
Tan-1323CFormula:
C45H74O14Smiles:
CC=CC1OC(O)(C(C)C(O)C(C)C2OC(=O)C(OC)=CC(C)=CC(C)C(O)C(CC)C(O)C(C)CC(C)=CC=CC2OC)CC(OC2OC(C)C(O)C(O)C2O)C1CAglycone:
CC=CC1OC(O)(C(C)C(O)C(C)C2OC(=O)C(OC)=CC(C)=CC(C)C(O)C(CC)C(O)C(C)CC(C)=CC=CC2OC)CC(O)C1CSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.76 |
| AlogP: | 3.85 | Num_rotatable_bonds: | 10 |
| MolWt: | 839.07 | Num_heavy_atoms: | 59 |
| TPSA: | 214.06 | NumAromaticRings: | 0 |
Unique Aglycone
AD03017
Formula: C39H64O10
Smiles:
CC=CC1OC(O)(C(C)C(O)C(C)C2OC(=O)C(OC)=CC(C)=CC(C)C(O)C(CC)C(O)C(C)CC(C)=CC=CC2OC)CC(O)C1C| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.72 |
| AlogP: | 5.0 | Num_rotatable_bonds: | 8 |
| MolWt: | 692.93 | Num_heavy_atoms: | 49 |
| TPSA: | 155.14 | NumAromaticRings: | 0 |
