GD149197

Name:

6-acetyl-8-(acetyloxy)-14-({5-[(3-hydroxy-4-methoxy-6-methyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-7,11-dimethyl-2-oxapentacyclo[8.8.0.0¹,³.0³,⁷.0¹¹,¹⁶]octadecan-9-yl benzoate

Formula:

C50H72O19

Smiles:

COC1CC(OC2CCC3(C)C(CCC45OC46CCC(C(C)=O)C6(C)C(OC(C)=O)C(OC(=O)c4ccccc4)C35)C2)OC(C)C1OC1OC(C)C(OC2OC(CO)C(O)C(O)C2O)C(OC)C1O

Aglycone:

CC(=O)OC1C(OC(=O)c2ccccc2)C2C3(C)CCC(O)CC3CCC23OC32CCC(C(C)=O)C12C

Sugarmoiety:

COC1CC(O)OC(C)C1OC1OC(C)C(OC2OC(CO)C(O)C(O)C2O)C(OC)C1O

Other Identifiers

• CNP0263352

AD22635

Formula: C30H38O7

Smiles:

CC(=O)OC1C(OC(=O)c2ccccc2)C2C3(C)CCC(O)CC3CCC23OC32CCC(C(C)=O)C12C

HBA:	7	RingCount:	6
HBD:	1	FractionCSP3:	0.7
AlogP:	4.25	Num_rotatable_bonds:	4
MolWt:	510.63	Num_heavy_atoms:	37
TPSA:	102.43	NumAromaticRings:	1