Glycoside

GD118299
Name:
2-{[4,8a-bis(hydroxymethyl)-14-methoxy-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl]oxy}-6-methyloxane-3,4,5-triolFormula:
C37H62O8Smiles:
COC1C=C2C3CC(C)(C)CCC3(CO)CCC2(C)C2(C)CCC3C(C)(CO)C(OC4OC(C)C(O)C(O)C4O)CCC3(C)C12Aglycone:
COC1C=C2C3CC(C)(C)CCC3(CO)CCC2(C)C2(C)CCC3C(C)(CO)C(O)CCC3(C)C12Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
HBA: | 8 | RingCount: | 6 |
HBD: | 5 | FractionCSP3: | 0.95 |
AlogP: | 4.59 | Num_rotatable_bonds: | 5 |
MolWt: | 634.9 | Num_heavy_atoms: | 45 |
TPSA: | 128.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD12601
Formula: C31H52O4
Smiles:
COC1C=C2C3CC(C)(C)CCC3(CO)CCC2(C)C2(C)CCC3C(C)(CO)C(O)CCC3(C)C12HBA: | 4 | RingCount: | 5 |
HBD: | 3 | FractionCSP3: | 0.94 |
AlogP: | 5.74 | Num_rotatable_bonds: | 3 |
MolWt: | 488.75 | Num_heavy_atoms: | 35 |
TPSA: | 69.92 | NumAromaticRings: | 0 |