GD035989

Name:

None

Formula:

C56H87O16N

Smiles:

COc1ccccc1CNC(=O)[C@@]12CCC(C)(C)C[C@H]1C1=CC[C@@H]3[C@]4(C)CC[C@H](O[C@@H]5O[C@H](CO)[C@H](O[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@H](C)[C@H](O)[C@H](O)[C@H]5O)C(C)(C)[C@H]4CC[C@@]3(C)[C@@]1(C)CC2

Aglycone:

COc1ccccc1CNC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC(O)C(C)(C)C4CCC3(C)C1(C)CC2

Sugarmoiety:

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

Other Identifiers

• CHEMBL4852883

AD22744

Formula: C38H57O3N

Smiles:

COc1ccccc1CNC(=O)C12CCC(C)(C)CC1C1=CCC3C4(C)CCC(O)C(C)(C)C4CCC3(C)C1(C)CC2

HBA:	4	RingCount:	6
HBD:	2	FractionCSP3:	0.76
AlogP:	8.47	Num_rotatable_bonds:	4
MolWt:	575.88	Num_heavy_atoms:	42
TPSA:	58.56	NumAromaticRings:	1