GD156697

Name:

6-[(4-methoxy-5-{[4-methoxy-5-({4-methoxy-5-[(4-methoxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-6-methyloxan-2-yl}oxy)-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl)oxy]-9,13,18-trimethyl-14-oxo-19,20-dioxapentacyclo[10.7.1.0¹,¹⁰.0⁴,⁹.0¹³,¹⁷]icosan-15-yl acetate

Formula:

C57H92O23

Smiles:

COC1CC(OC2CCC3(C)C(CCC45OC(C)C6CC(OC(C)=O)C(=O)C6(C)C(CC43)O5)C2)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(OC)C(OC4OC(CO)C(O)C(O)C4O)C(C)O3)C(C)O2)C(C)O1

Aglycone:

CC(=O)OC1CC2C(C)OC34CCC5CC(O)CCC5(C)C3CC(O4)C2(C)C1=O

Sugarmoiety:

COC1CC(O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3CC(OC)C(OC4OC(CO)C(O)C(O)C4O)C(C)O3)C(C)O2)C(C)O1

Other Identifiers

• CNP0168789

AD54249

Formula: C23H34O6

Smiles:

CC(=O)OC1CC2C(C)OC34CCC5CC(O)CCC5(C)C3CC(O4)C2(C)C1=O

HBA:	6	RingCount:	5
HBD:	1	FractionCSP3:	0.91
AlogP:	2.99	Num_rotatable_bonds:	1
MolWt:	406.52	Num_heavy_atoms:	29
TPSA:	82.06	NumAromaticRings:	0