GD132740

Name:

Aurantoside H

Formula:

C29H35O12N2Cl

Smiles:

CC(Cl)=CC=CC=CC=CC=CC(O)=C1C(=O)C(CC(=N)O)N(C2OCC(O)C(O)C2OC2OCC(O)C(O)C2O)C1=O

Aglycone:

CC(Cl)=CC=CC=CC=CC=CC(O)=C1C(=O)NC(CC(=N)O)C1=O

Sugarmoiety:

OC1COC(OC2C(O)OCC(O)C2O)C(O)C1O

Other Identifiers

• CNP0319884

AD51880

Formula: C19H19O4N2Cl

Smiles:

CC(Cl)=CC=CC=CC=CC=CC(O)=C1C(=O)NC(CC(=N)O)C1=O

HBA:	6	RingCount:	1
HBD:	4	FractionCSP3:	0.17
AlogP:	3.16	Num_rotatable_bonds:	7
MolWt:	362.81	Num_heavy_atoms:	25
TPSA:	110.48	NumAromaticRings:	0