Glycoside
GD115352
Name:
N-(1-{[3,4-dihydroxy-6-(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-3-hydroxyoct-4-en-2-yl)tetracosanamideFormula:
C44H83O13NSmiles:
CCCC=CC(O)C(COC1OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C(O)C1O)N=C(O)CCCCCCCCCCCCCCCCCCCCCCCAglycone:
CCCC=CC(O)C(CO)N=C(O)CCCCCCCCCCCCCCCCCCCCCCCSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 9 | FractionCSP3: | 0.93 |
| AlogP: | 5.27 | Num_rotatable_bonds: | 34 |
| MolWt: | 834.14 | Num_heavy_atoms: | 58 |
| TPSA: | 231.35 | NumAromaticRings: | 0 |
Unique Aglycone
AD45612
Formula: C32H63O3N
Smiles:
CCCC=CC(O)C(CO)N=C(O)CCCCCCCCCCCCCCCCCCCCCCC| HBA: | 4 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.91 |
| AlogP: | 9.62 | Num_rotatable_bonds: | 28 |
| MolWt: | 509.86 | Num_heavy_atoms: | 36 |
| TPSA: | 73.05 | NumAromaticRings: | 0 |
