GD115133

Name:

[3,4,5-tris(acetyloxy)-6-{[8-(6-hydroxy-6-methylhept-4-en-2-yl)-5,9,17,17-tetramethyl-18-oxapentacyclo[10.5.2.0¹,¹³.0⁴,¹².0⁵,⁹]nonadec-2-en-16-yl]oxy}oxan-2-yl]methyl acetate

Formula:

C44H66O12

Smiles:

CC(=O)OCC1OC(OC2CCC3C45CCC6(C)C(C(C)CC=CC(C)(C)O)CCC6(C)C4C=CC3(OC5)C2(C)C)C(OC(C)=O)C(OC(C)=O)C1OC(C)=O

Aglycone:

CC(CC=CC(C)(C)O)C1CCC2(C)C3C=CC45OCC3(CCC12C)C4CCC(O)C5(C)C.COC(C)=O

Sugarmoiety:

CC(=O)OC1C(O)OC(O)C(OC(C)=O)C1OC(C)=O

Other Identifiers

• CNP0277683

AD00017

Formula: C3H6O2

Smiles:

COC(C)=O

HBA:	2	RingCount:	0
HBD:	0	FractionCSP3:	0.67
AlogP:	0.18	Num_rotatable_bonds:	0
MolWt:	74.08	Num_heavy_atoms:	5
TPSA:	26.3	NumAromaticRings:	0

AD07869

Formula: C30H48O3

Smiles:

CC(CC=CC(C)(C)O)C1CCC2(C)C3C=CC45OCC3(CCC12C)C4CCC(O)C5(C)C

HBA:	3	RingCount:	5
HBD:	2	FractionCSP3:	0.87
AlogP:	6.29	Num_rotatable_bonds:	4
MolWt:	456.71	Num_heavy_atoms:	33
TPSA:	49.69	NumAromaticRings:	0