GD141759

Name:

2-({6-[(6-{[6-({7,14-dihydroxy-5,19-dimethyl-15,18,20-trioxahexacyclo[14.5.1.0¹,¹⁴.0⁴,¹³.0⁵,¹⁰.0¹⁹,²²]docos-10-en-8-yl}oxy)-4-methoxy-2-methyloxan-3-yl]oxy}-4-methoxy-2-methyloxan-3-yl)oxy]-4-methoxy-2-methyloxan-3-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:

C48H76O20

Smiles:

COC1CC(OC2CC3=CCC4C(CCC56COC7(C)OCC(OC45O)C76)C3(C)CC2O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(CO)C(O)C(O)C3O)C(C)O2)C(C)O1

Aglycone:

CC12OCC3OC4(O)C5CC=C6CC(O)C(O)CC6(C)C5CCC4(CO1)C32

Sugarmoiety:

COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(CO)C(O)C(O)C3O)C(C)O2)C(C)O1

Other Identifiers

• CNP0151698

AD57083

Formula: C21H30O6

Smiles:

CC12OCC3OC4(O)C5CC=C6CC(O)C(O)CC6(C)C5CCC4(CO1)C32

HBA:	6	RingCount:	6
HBD:	3	FractionCSP3:	0.9
AlogP:	1.33	Num_rotatable_bonds:	0
MolWt:	378.47	Num_heavy_atoms:	27
TPSA:	88.38	NumAromaticRings:	0