GD038883

Name:

Iv A

Formula:

C40H51O14N

Smiles:

CC[C@]1(O)C[C@@H](O[C@@H]2C[C@@H](N(C)C)[C@@H](O[C@@H]3C[C@@H](O)[C@@H](O[C@@H]4CCC(=O)[C@@H](C)O4)[C@@H](C)O3)[C@@H](C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)[C@H]1O

Aglycone:

CC1OC(O)CCC1=O.CCC1(O)CC(OC2CC(N(C)C)C(O)C(C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)C1O

Sugarmoiety:

CC1OC(O)CC(O)C1O

Other Identifiers

• CNP0204184
• DRA

AD00014

Formula: C6H10O3

Smiles:

CC1OC(O)CCC1=O

HBA:	3	RingCount:	1
HBD:	1	FractionCSP3:	0.83
AlogP:	0.07	Num_rotatable_bonds:	0
MolWt:	130.14	Num_heavy_atoms:	9
TPSA:	46.53	NumAromaticRings:	0

AD24167

Formula: C28H33O9N

Smiles:

CCC1(O)CC(OC2CC(N(C)C)C(O)C(C)O2)c2c(cc3c(c2O)C(=O)c2c(O)cccc2C3=O)C1O

HBA:	10	RingCount:	5
HBD:	5	FractionCSP3:	0.5
AlogP:	1.94	Num_rotatable_bonds:	4
MolWt:	527.57	Num_heavy_atoms:	38
TPSA:	156.99	NumAromaticRings:	2