Glycoside
GD117867
Name:
N-(3,4-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}nonadec-11-en-2-yl)-2-hydroxyicosanamideFormula:
C45H87O10NSmiles:
CCCCCCCC=CCCCCCCC(O)C(O)C(COC1OC(CO)C(O)C(O)C1O)N=C(O)C(O)CCCCCCCCCCCCCCCCCCAglycone:
CCCCCCCC=CCCCCCCC(O)C(O)C(CO)N=C(O)C(O)CCCCCCCCCCCCCCCCCCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.93 |
| AlogP: | 8.12 | Num_rotatable_bonds: | 38 |
| MolWt: | 802.19 | Num_heavy_atoms: | 56 |
| TPSA: | 192.66 | NumAromaticRings: | 0 |
Unique Aglycone
AD47056
Formula: C39H77O5N
Smiles:
CCCCCCCC=CCCCCCCC(O)C(O)C(CO)N=C(O)C(O)CCCCCCCCCCCCCCCCCC| HBA: | 6 | RingCount: | 0 |
| HBD: | 5 | FractionCSP3: | 0.92 |
| AlogP: | 10.3 | Num_rotatable_bonds: | 35 |
| MolWt: | 640.05 | Num_heavy_atoms: | 45 |
| TPSA: | 113.51 | NumAromaticRings: | 0 |
