Glycoside
GD115354
Name:
N-(3,4-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}hexadecan-2-yl)-2-hydroxyicosanamideFormula:
C42H83O10NSmiles:
CCCCCCCCCCCCCCCCCCC(O)C(O)=NC(COC1OC(CO)C(O)C(O)C1O)C(O)C(O)CCCCCCCCCCCCAglycone:
CCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.98 |
| AlogP: | 7.17 | Num_rotatable_bonds: | 36 |
| MolWt: | 762.12 | Num_heavy_atoms: | 53 |
| TPSA: | 192.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD45614
Formula: C36H73O5N
Smiles:
CCCCCCCCCCCCCCCCCCC(O)C(O)=NC(CO)C(O)C(O)CCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.97 |
| AlogP: | 9.35 | Num_rotatable_bonds: | 33 |
| MolWt: | 599.98 | Num_heavy_atoms: | 42 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
