GD142938

Name:

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

Formula:

C45H75O16N

Smiles:

CC1CCC2C(C)C3C(CC4C5CC(O)C6(O)CC(OC7OC(CO)C(OC8OC(C)C(O)C(O)C8O)C(O)C7OC7OC(C)C(O)C(O)C7O)CCC6(C)C5CCC43C)N2C1

Aglycone:

CC1CCC2C(C)C3C(CC4C5CC(O)C6(O)CC(O)CCC6(C)C5CCC43C)N2C1

Sugarmoiety:

CC1OC(OC2C(O)OC(CO)C(OC3OC(C)C(O)C(O)C3O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0116602

AD57507

Formula: C27H45O3N

Smiles:

CC1CCC2C(C)C3C(CC4C5CC(O)C6(O)CC(O)CCC6(C)C5CCC43C)N2C1

HBA:	4	RingCount:	6
HBD:	3	FractionCSP3:	1.0
AlogP:	3.82	Num_rotatable_bonds:	0
MolWt:	431.66	Num_heavy_atoms:	31
TPSA:	63.93	NumAromaticRings:	0