GD150669

Name:

2-{[4,5-dihydroxy-6-({2-hydroxy-4,5,7,7,13,20,20-heptamethyl-24-oxahexacyclo[15.5.2.0¹,¹⁸.0⁴,¹⁷.0⁵,¹⁴.0⁸,¹³]tetracos-15-en-10-yl}oxy)-2-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

Formula:

C48H78O17

Smiles:

CC1OC(OC2C(COC3OC(CO)C(O)C(O)C3O)OC(OC3CCC4(C)C(C3)C(C)(C)CC3(C)C4C=CC45OCC6(CCC(C)(C)CC64)C(O)CC35C)C(O)C2O)C(O)C(O)C1O

Aglycone:

CC1(C)CCC23COC4(C=CC5C6(C)CCC(O)CC6C(C)(C)CC5(C)C4(C)CC2O)C3C1

Sugarmoiety:

CC1OC(OC2C(COC3OC(CO)C(O)C(O)C3O)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0145434

AD60161

Formula: C30H48O3

Smiles:

CC1(C)CCC23COC4(C=CC5C6(C)CCC(O)CC6C(C)(C)CC5(C)C4(C)CC2O)C3C1

HBA:	3	RingCount:	6
HBD:	2	FractionCSP3:	0.93
AlogP:	6.13	Num_rotatable_bonds:	0
MolWt:	456.71	Num_heavy_atoms:	33
TPSA:	49.69	NumAromaticRings:	0