Glycoside
GD134499
Name:
burnettramic acid aFormula:
C41H71O12NSmiles:
CC(CCCCCCCCCC=CCC(O)CCCC(O)CCCCCOC1OC(CO)C(O)C(O)C1O)CC(C)C(O)=C1C(=O)C2CC(O)CN2C1=OAglycone:
CC(CCCCCCCCCC=CCC(O)CCCC(O)CCCCCO)CC(C)C(O)=C1C(=O)C2CC(O)CN2C1=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.85 |
| AlogP: | 3.73 | Num_rotatable_bonds: | 27 |
| MolWt: | 770.01 | Num_heavy_atoms: | 54 |
| TPSA: | 217.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD54408
Formula: C35H61O7N
Smiles:
CC(CCCCCCCCCC=CCC(O)CCCC(O)CCCCCO)CC(C)C(O)=C1C(=O)C2CC(O)CN2C1=O| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.83 |
| AlogP: | 5.91 | Num_rotatable_bonds: | 24 |
| MolWt: | 607.87 | Num_heavy_atoms: | 43 |
| TPSA: | 138.53 | NumAromaticRings: | 0 |
