GD126228

Name:

None

Formula:

C65H120O22N2

Smiles:

CCCCCCCCCCCCCCC=CC(O)C(COC1OC(CO)C(OC2OC(CO)C(O)C(OC3(C(=O)O)CC(O)C(N=C(C)O)C(C(O)C(CO)OC)O3)C2O)C(O)C1O)N=C(O)C(O)CCCCCCCCCCCCCCCCCCCC

Aglycone:

CCCCCCCCCCCCCCC=CC(O)C(CO)N=C(O)C(O)CCCCCCCCCCCCCCCCCCCC.COC(CO)C(O)C1OC(O)(C(=O)O)CC(O)C1N=C(C)O

Sugarmoiety:

OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

• CNP0429632

AD51062

Formula: C41H81O4N

Smiles:

CCCCCCCCCCCCCCC=CC(O)C(CO)N=C(O)C(O)CCCCCCCCCCCCCCCCCCCC

HBA:	5	RingCount:	0
HBD:	4	FractionCSP3:	0.93
AlogP:	12.1	Num_rotatable_bonds:	37
MolWt:	652.1	Num_heavy_atoms:	46
TPSA:	93.28	NumAromaticRings:	0

AD51063

Formula: C12H21O9N

Smiles:

COC(CO)C(O)C1OC(O)(C(=O)O)CC(O)C1N=C(C)O

HBA:	10	RingCount:	1
HBD:	6	FractionCSP3:	0.83
AlogP:	-2.38	Num_rotatable_bonds:	6
MolWt:	323.3	Num_heavy_atoms:	22
TPSA:	169.27	NumAromaticRings:	0