GD130835

Name:

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

Formula:

C45H73O15N

Smiles:

CC1CCC2C(C)C3C(CC4C5C(O)C=C6CC(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(CC4C5C(O)C=C6CC(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

• CNP0196719

AD53011

Formula: C27H43O2N

Smiles:

CC1CCC2C(C)C3C(CC4C5C(O)C=C6CC(O)CCC6(C)C5CCC43C)N2C1

HBA:	3	RingCount:	6
HBD:	2	FractionCSP3:	0.93
AlogP:	4.63	Num_rotatable_bonds:	0
MolWt:	413.65	Num_heavy_atoms:	30
TPSA:	43.7	NumAromaticRings:	0