GD121231

Name:

None

Formula:

C34H37O13N3

Smiles:

CC(C)C(CNC(O)C1(O)C(Oc2ccc3c(=O)c(-c4ccc(O)cc4)c(C(N)=O)oc3c2)OC(C(=O)O)C(O)C1(O)C=O)Cc1cc[nH]c1

Aglycone:

CC(C)C(CNCO)Cc1cc[nH]c1.NC(=O)c1oc2cc(O)ccc2c(=O)c1-c1ccc(O)cc1

Sugarmoiety:

O=CC1(O)C(O)C(C(=O)O)OC(O)C1(O)O

Other Identifiers

• CNP0443835

AD46349

Formula: C16H11O5N

Smiles:

NC(=O)c1oc2cc(O)ccc2c(=O)c1-c1ccc(O)cc1

HBA:	6	RingCount:	3
HBD:	4	FractionCSP3:	0.0
AlogP:	1.97	Num_rotatable_bonds:	2
MolWt:	297.27	Num_heavy_atoms:	22
TPSA:	113.76	NumAromaticRings:	3

AD47345

Formula: C11H20ON2

Smiles:

CC(C)C(CNCO)Cc1cc[nH]c1

HBA:	3	RingCount:	1
HBD:	3	FractionCSP3:	0.64
AlogP:	1.37	Num_rotatable_bonds:	6
MolWt:	196.29	Num_heavy_atoms:	14
TPSA:	48.05	NumAromaticRings:	1