GD021880

Name:

None

Formula:

C46H66O15

Smiles:

CC(=O)OC[C@H](C)[C@]1(O)[C@H](OC2OCC(O)C(OC3OCC(O)C(O)C3OC(C)c3ccccc3)C2OC(C)=O)CC2C3CC=C4C[C@H](OC(C)=O)CC[C@@]4(C)C3CC[C@]21C

Aglycone:

CC(=O)OCC(C)C1(O)C(O)CC2C3CC=C4CC(OC(C)=O)CCC4(C)C3CCC21C.CC(O)c1ccccc1

Sugarmoiety:

CC(=O)OC1C(O)OCC(O)C1OC1OCC(O)C(O)C1O

Other Identifiers

• CHEMBL302568

AD07101

Formula: C8H10O

Smiles:

CC(O)c1ccccc1

HBA:	1	RingCount:	1
HBD:	1	FractionCSP3:	0.25
AlogP:	1.74	Num_rotatable_bonds:	1
MolWt:	122.17	Num_heavy_atoms:	9
TPSA:	20.23	NumAromaticRings:	1

AD14894

Formula: C26H40O6

Smiles:

CC(=O)OCC(C)C1(O)C(O)CC2C3CC=C4CC(OC(C)=O)CCC4(C)C3CCC21C

HBA:	6	RingCount:	4
HBD:	2	FractionCSP3:	0.85
AlogP:	3.78	Num_rotatable_bonds:	4
MolWt:	448.6	Num_heavy_atoms:	32
TPSA:	93.06	NumAromaticRings:	0