Compound C25H40O6

7-[8-(2,2-dimethylbutanoyloxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid

CAS: 1394115-93-5

Molecular Formula	`C25H40O6`
Molecular Weight	436.6 g/mol
LogP	3.9
Topological Polar Surface Area	104.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	11
Exact Mass	436.2825
Heavy Atoms	31
Complexity	694.0

Chemical Identifiers

CAS Number	1394115-93-5
SMILES	`CCC(C)(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)O)O)O)C`
InChIKey	`XWLXKKNPFMNSFA-UHFFFAOYSA-N`

📖 Product Overview

Compound C25H40O6 (CAS: 1394115-93-5) is a chemical compound with molecular formula C25H40O6 and molecular weight 436.6 g/mol. Its IUPAC systematic name is 7-[8-(2,2-dimethylbutanoyloxy)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]-3,5-dihydroxyheptanoic acid. LogP 3.9 Topological Polar Surface Area 104.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 11 Exact Mass 436.2825 Heavy Atoms 31 Complexity 694.0 InChI Key: XWLXKKNPFMNSFA-UHFFFAOYSA-N. SMILES: CCC(C)(C)C(=O)OC1CC(C=C2C1C(C(C=C2)C)CCC(CC(CC(=O)O)O)O)C.

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