Glycoside
GD147611
Name:
A83543CFormula:
C39H61O10NSmiles:
CCC1CCCC(OC2CCC(N)C(C)O2)C(C)C(=O)C2=CC3C(C=CC4CC(OC5OC(C)C(OC)C(OC)C5OC)CC43)C2CC(=O)O1Aglycone:
CCC1CCCC(OC2CCC(N)C(C)O2)C(C)C(=O)C2=CC3C(C=CC4CC(O)CC43)C2CC(=O)O1Sugarmoiety:
COC1C(C)OC(O)C(OC)C1OCOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 2 | FractionCSP3: | 0.85 |
| AlogP: | 4.88 | Num_rotatable_bonds: | 8 |
| MolWt: | 703.91 | Num_heavy_atoms: | 50 |
| TPSA: | 134.0 | NumAromaticRings: | 0 |
Unique Aglycone
AD59103
Formula: C30H45O6N
Smiles:
CCC1CCCC(OC2CCC(N)C(C)O2)C(C)C(=O)C2=CC3C(C=CC4CC(O)CC43)C2CC(=O)O1| HBA: | 7 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | 4.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 515.69 | Num_heavy_atoms: | 37 |
| TPSA: | 108.08 | NumAromaticRings: | 0 |
