GD006670

Name:

None

Formula:

C45H70O16

Smiles:

CCCC(=O)O[C@@H]1[C@H](OC(=O)CCC)[C@@H](OC)[C@H](O[C@@H]2C[C@@H]3C[C@H](C)C=CC=CC[C@@H]4O[C@H](C[C@H]4C)[C@H](O)C[C@@H]4OC(=O)[C@@](O)([C@H]4O)[C@H](OC(=O)CCC)C[C@H](C2)O3)O[C@@H]1C

Aglycone:

CCCC(=O)O.CCCC(=O)O.CCCC(=O)OC1CC2CC(O)CC(CC(C)C=CC=CCC3OC(CC3C)C(O)CC3OC(=O)C1(O)C3O)O2

Sugarmoiety:

COC1C(O)OC(C)C(O)C1O

Other Identifiers

• CHEMBL4090765
• CNP0435135

AD00922

Formula: C4H8O2

Smiles:

CCCC(=O)O

HBA:	2	RingCount:	0
HBD:	1	FractionCSP3:	0.75
AlogP:	0.87	Num_rotatable_bonds:	2
MolWt:	88.11	Num_heavy_atoms:	6
TPSA:	37.3	NumAromaticRings:	0

AD05493

Formula: C30H46O10

Smiles:

CCCC(=O)OC1CC2CC(O)CC(CC(C)C=CC=CCC3OC(CC3C)C(O)CC3OC(=O)C1(O)C3O)O2

HBA:	10	RingCount:	4
HBD:	4	FractionCSP3:	0.8
AlogP:	2.1	Num_rotatable_bonds:	3
MolWt:	566.69	Num_heavy_atoms:	40
TPSA:	151.98	NumAromaticRings:	0