GD119867

Name:

2-[(2-{[3,5-dihydroxy-2-(hydroxymethyl)-6-{5',7,9,13-tetramethyl-5-oxaspiro[pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosane-6,2'-piperidin]-18-en-3'-oloxy}oxan-4-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl)oxy]-6-methyloxane-3,4,5-triol

Formula:

C45H73O17N

Smiles:

CC1CNC2(OC3CC4C5CC=C6CC(OC7OC(CO)C(O)C(OC8OC(CO)C(O)C(O)C8OC8OC(C)C(O)C(O)C8O)C7O)CCC6(C)C5CCC4(C)C3C2C)C(O)C1

Aglycone:

CC1CNC2(OC3CC4C5CC=C6CC(O)CCC6(C)C5CCC4(C)C3C2C)C(O)C1

Sugarmoiety:

CC1OC(OC2C(OC3C(O)C(O)OC(CO)C3O)OC(CO)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0323383

AD48095

Formula: C27H43O3N

Smiles:

CC1CNC2(OC3CC4C5CC=C6CC(O)CCC6(C)C5CCC4(C)C3C2C)C(O)C1

HBA:	4	RingCount:	6
HBD:	3	FractionCSP3:	0.93
AlogP:	4.26	Num_rotatable_bonds:	0
MolWt:	429.65	Num_heavy_atoms:	31
TPSA:	61.72	NumAromaticRings:	0