GD128955

Name:

[3,4-bis(acetyloxy)-5-hydroxy-6-[4-hydroxy-5-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trien-1-yl)phenoxy]oxan-2-yl]methyl acetate

Formula:

C34H48O10

Smiles:

CC(=O)OCC1OC(Oc2cc(C)c(O)cc2CC=C(C)CCC=C(C)CCC=C(C)C)C(O)C(OC(C)=O)C1OC(C)=O

Aglycone:

CC(C)=CCCC(C)=CCCC(C)=CCc1cc(O)c(C)cc1O.COC(C)=O

Sugarmoiety:

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

Other Identifiers

• CNP0282370

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

AD47987

Formula: C22H32O2

Smiles:

CC(C)=CCCC(C)=CCCC(C)=CCc1cc(O)c(C)cc1O

HBA:	2	RingCount:	1
HBD:	2	FractionCSP3:	0.45
AlogP:	6.37	Num_rotatable_bonds:	8
MolWt:	328.5	Num_heavy_atoms:	24
TPSA:	40.46	NumAromaticRings:	1