Glycoside
GD034231
Name:
NoneFormula:
C34H64O9N3PSSmiles:
CCCCCCCCCCCCSCC(COP(=O)(O)OCC1OC(n2ccc(N)nc2=O)[C@H](O)C1O)OCCCCCCCCCCAglycone:
CCCCCCCCCCCCSCC(COP(=O)(O)OC)OCCCCCCCCCC.Nc1cc[nH]c(=O)n1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | 6.76 | Num_rotatable_bonds: | 30 |
| MolWt: | 721.94 | Num_heavy_atoms: | 48 |
| TPSA: | 175.59 | NumAromaticRings: | 1 |
Unique Aglycone
AD00115
Formula: C4H5ON3
Smiles:
Nc1cc[nH]c(=O)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 111.1 | Num_heavy_atoms: | 8 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
AD13845
Formula: C26H55O5PS
Smiles:
CCCCCCCCCCCCSCC(COP(=O)(O)OC)OCCCCCCCCCC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 8.93 | Num_rotatable_bonds: | 27 |
| MolWt: | 510.76 | Num_heavy_atoms: | 33 |
| TPSA: | 64.99 | NumAromaticRings: | 0 |
