Glycoside
GD146098
Name:
2-decarboxy-12-methyl pimaricinFormula:
C33H49O11NSmiles:
CC1CC=CC=CC=CC=CC(OC2OC(C)C(O)C(N)C2O)CC2OC(O)(CC(O)CC3OC3C=CC(=O)O1)CC(O)C2CAglycone:
CC1CC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)CC3OC3C=CC(=O)O1)CC(O)C2CSugarmoiety:
CC1OC(O)C(O)C(N)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.67 |
| AlogP: | 1.06 | Num_rotatable_bonds: | 2 |
| MolWt: | 635.75 | Num_heavy_atoms: | 45 |
| TPSA: | 193.69 | NumAromaticRings: | 0 |
Unique Aglycone
AD58605
Formula: C27H38O8
Smiles:
CC1CC=CC=CC=CC=CC(O)CC2OC(O)(CC(O)CC3OC3C=CC(=O)O1)CC(O)C2C| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | 2.24 | Num_rotatable_bonds: | 0 |
| MolWt: | 490.59 | Num_heavy_atoms: | 35 |
| TPSA: | 128.98 | NumAromaticRings: | 0 |
