GD141465

Name:

13-(acetyloxy)-7-{[5-({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)-4-methoxy-6-methyloxan-2-yl]oxy}-10,17-dimethyl-16,21-dioxahexacyclo[15.3.1.0¹,¹⁴.0²,¹¹.0⁵,¹⁰.0¹⁴,¹⁸]henicosan-12-yl 3-phenylprop-2-enoate

Formula:

C59H86O22

Smiles:

COC1CC(OC2CCC3(C)C(CCC4C3C(OC(=O)C=Cc3ccccc3)C(OC(C)=O)C35COC6(C)OC43CCC65)C2)OC(C)C1OC1CC(OC)C(OC2OC(C)C(OC3OC(CO)C(O)C(O)C3O)C(OC)C2O)C(C)O1

Aglycone:

CC(=O)OC1C(OC(=O)C=Cc2ccccc2)C2C(CCC3CC(O)CCC32C)C23CCC4C(C)(OCC142)O3

Sugarmoiety:

COC1CC(O)OC(C)C1OC1CC(OC)C(OC2OC(C)C(OC3OC(CO)C(O)C(O)C3O)C(OC)C2O)C(C)O1

Other Identifiers

• CNP0113645

AD56988

Formula: C32H40O7

Smiles:

CC(=O)OC1C(OC(=O)C=Cc2ccccc2)C2C(CCC3CC(O)CCC32C)C23CCC4C(C)(OCC142)O3

HBA:	7	RingCount:	7
HBD:	1	FractionCSP3:	0.69
AlogP:	4.66	Num_rotatable_bonds:	4
MolWt:	536.67	Num_heavy_atoms:	39
TPSA:	91.29	NumAromaticRings:	1