GD029386

Name:

None

Formula:

C44H67O11N

Smiles:

CC(=O)OC[C@@H]1O[C@H](NC(=O)[C@@]23CCC(C)(C)C[C@H]2C2=CC[C@@H]4[C@]5(C)CC[C@H](O)C(C)(C)[C@H]5CC[C@@]4(C)[C@@]2(C)CC3)[C@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O

Aglycone:

CC1(C)CCC2(C(N)=O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1.COC(C)=O

Sugarmoiety:

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• CHEMBL4754438
• CHEMBL4780325

AD00017

Formula: C3H6O2

Smiles:

COC(C)=O

HBA:	2	RingCount:	0
HBD:	0	FractionCSP3:	0.67
AlogP:	0.18	Num_rotatable_bonds:	0
MolWt:	74.08	Num_heavy_atoms:	5
TPSA:	26.3	NumAromaticRings:	0

AD19116

Formula: C30H49O2N

Smiles:

CC1(C)CCC2(C(N)=O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1

HBA:	3	RingCount:	5
HBD:	3	FractionCSP3:	0.9
AlogP:	6.63	Num_rotatable_bonds:	1
MolWt:	455.73	Num_heavy_atoms:	33
TPSA:	63.32	NumAromaticRings:	0