GD139615

Name:

2-{[5-hydroxy-6-(hydroxymethyl)-2-{[3,4,5-trihydroxy-6-({10,14,16,20-tetramethyl-22-azahexacyclo[12.10.0.0²,¹¹.0⁵,¹⁰.0¹⁵,²³.0¹⁷,²²]tetracosan-7-yl}oxy)oxan-2-yl]methoxy}-4-[(3,4,5-trihydroxyoxan-2-yl)oxy]oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

Formula:

C50H83O20N

Smiles:

CC1CCC2C(C)C3C(CC4C5CCC6CC(OC7OC(COC8OC(CO)C(O)C(OC9OCC(O)C(O)C9O)C8OC8OC(CO)C(O)C(O)C8O)C(O)C(O)C7O)CCC6(C)C5CCC43C)N2C1

Aglycone:

CC1CCC2C(C)C3C(CC4C5CCC6CC(O)CCC6(C)C5CCC43C)N2C1

Sugarmoiety:

OCC1OC(OC2C(OCC3OC(O)C(O)C(O)C3O)OC(CO)C(O)C2OC2OCC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0102297

AD52431

Formula: C27H45ON

Smiles:

CC1CCC2C(C)C3C(CC4C5CCC6CC(O)CCC6(C)C5CCC43C)N2C1

HBA:	2	RingCount:	6
HBD:	1	FractionCSP3:	1.0
AlogP:	5.73	Num_rotatable_bonds:	0
MolWt:	399.66	Num_heavy_atoms:	29
TPSA:	23.47	NumAromaticRings:	0