Glycoside

GD155781
Name:
"1'-(6""- 0- (I I "" '-Methyllauryl) -P-Glucopyranosyloxy]-3,4,3',4'-Tetradehydro-1,2,1',2'-Tetrahydro-I -Hydroxy- Yl, Yl-Carotene"Formula:
C59H90O8Smiles:
CC(C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)OC1OC(COC(=O)CCCCCCCCCC(C)C)C(O)C(O)C1OAglycone:
CC(C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O.COC(=O)CCCCCCCCCC(C)CSugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 8 | RingCount: | 1 |
HBD: | 4 | FractionCSP3: | 0.54 |
AlogP: | 13.42 | Num_rotatable_bonds: | 30 |
MolWt: | 927.36 | Num_heavy_atoms: | 67 |
TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD46765
Formula: C14H28O2
Smiles:
COC(=O)CCCCCCCCCC(C)CHBA: | 2 | RingCount: | 0 |
HBD: | 0 | FractionCSP3: | 0.93 |
AlogP: | 4.33 | Num_rotatable_bonds: | 10 |
MolWt: | 228.38 | Num_heavy_atoms: | 16 |
TPSA: | 26.3 | NumAromaticRings: | 0 |
AD48271
Formula: C40H56O2
Smiles:
CC(C=CC=C(C)C=CC=C(C)C=CCC(C)(C)O)=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C=CCC(C)(C)OHBA: | 2 | RingCount: | 0 |
HBD: | 2 | FractionCSP3: | 0.35 |
AlogP: | 10.88 | Num_rotatable_bonds: | 16 |
MolWt: | 568.89 | Num_heavy_atoms: | 42 |
TPSA: | 40.46 | NumAromaticRings: | 0 |