GD027517

Name:

None

Formula:

C54H78O14N2

Smiles:

C[C@@H]1[C@H](O)[C@H](CO)O[C@H](O[C@@H]2[C@H](O[C@@H]3CC[C@]4(C)[C@H](CC[C@]5(C)[C@H]4C(=O)C=C4[C@@H]6C[C@](C)(CN[C@H](Cc7c[nH]c8ccccc78)C(=O)O)CC[C@@]6(C)CC[C@]45C)C3(C)C)O[C@H](C(=O)O)[C@H](O)[C@H]2O)[C@H]1O

Aglycone:

CC1(CNC(Cc2c[nH]c3ccccc23)C(=O)O)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1

Sugarmoiety:

CC1C(O)C(CO)OC(OC2C(O)OC(C(=O)O)C(O)C2O)C1O

Other Identifiers

• CHEMBL2314415

AD18080

Formula: C41H58O4N2

Smiles:

CC1(CNC(Cc2c[nH]c3ccccc23)C(=O)O)CCC2(C)CCC3(C)C(=CC(=O)C4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1

HBA:	6	RingCount:	7
HBD:	4	FractionCSP3:	0.71
AlogP:	8.09	Num_rotatable_bonds:	6
MolWt:	642.93	Num_heavy_atoms:	47
TPSA:	102.42	NumAromaticRings:	2