GD036448

Name:

None

Formula:

C45H70O15

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]4C[C@@](O)(C(=O)O4)[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)CC3CC1(O)C(=O)O3)O2

Sugarmoiety:

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

Other Identifiers

• CHEMBL4074785
• CNP0435910

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

AD12907

Formula: C30H46O9

Smiles:

CCCC(=O)OC1CC2CC(O)CC(CC(C)C=CC=CCC3OC(CC3C)C(O)CC3CC1(O)C(=O)O3)O2

HBA:	9	RingCount:	4
HBD:	3	FractionCSP3:	0.8
AlogP:	3.13	Num_rotatable_bonds:	3
MolWt:	550.69	Num_heavy_atoms:	39
TPSA:	131.75	NumAromaticRings:	0