GD019909

Name:

6-[(4,5-dihydroxy-6-{[4-(3-hydroxy-3-methylpent-4-en-1-yl)-3,4,8,8a-tetramethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-1-yl]oxy}-2-methyloxan-3-yl)oxy]-4,5-dihydroxy-2-(hydroxymethyl)oxan-3-yl acetate

Formula:

C34H56O12

Smiles:

C=C[C@@](C)(O)CC[C@@]1(C)[C@H](C)C[C@H](O[C@@H]2O[C@H](C)[C@H](O[C@@H]3O[C@H](CO)[C@H](OC(C)=O)[C@H](O)[C@H]3O)[C@H](O)[C@H]2O)[C@]2(C)C(C)=CCC[C@@H]21

Aglycone:

C=CC(C)(O)CCC1(C)C(C)CC(O)C2(C)C(C)=CCCC12

Sugarmoiety:

CC(=O)OC1C(CO)OC(OC2C(C)OC(O)C(O)C2O)C(O)C1O

Other Identifiers

• CHEMBL221551
• CNP0292641

AD12492

Formula: C20H34O2

Smiles:

C=CC(C)(O)CCC1(C)C(C)CC(O)C2(C)C(C)=CCCC12

HBA:	2	RingCount:	2
HBD:	2	FractionCSP3:	0.8
AlogP:	4.47	Num_rotatable_bonds:	4
MolWt:	306.49	Num_heavy_atoms:	22
TPSA:	40.46	NumAromaticRings:	0