GD098089

Name:

None

Formula:

C21H30O10N4

Smiles:

CC(=O)OC[C@H]1O[C@@H](n2cc(N[C@](C)(C(N)=O)C(C)C)c(=O)[nH]c2=O)[C@H](OC(C)=O)[C@@H]1OC(C)=O

Aglycone:

CC(C)C(C)(Nc1c[nH]c(=O)[nH]c1=O)C(N)=O.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• ZINC001167422791

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

AD41735

Formula: C10H16O3N4

Smiles:

CC(C)C(C)(Nc1c[nH]c(=O)[nH]c1=O)C(N)=O

HBA:	7	RingCount:	1
HBD:	5	FractionCSP3:	0.5
AlogP:	-0.62	Num_rotatable_bonds:	4
MolWt:	240.26	Num_heavy_atoms:	17
TPSA:	120.84	NumAromaticRings:	1