Spiculisporic acid

(2S)-2-[(1S)-1-carboxyundecyl]-5-oxooxolane-2-carboxylic acid

CAS: 469-77-2

Molecular Formula	`C17H28O6`
Molecular Weight	328.4 g/mol
LogP	4.4
Topological Polar Surface Area	101.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	6
Rotatable Bonds	12
Exact Mass	328.1886
Heavy Atoms	23
Complexity	419.0

Chemical Identifiers

CAS Number	469-77-2
SMILES	`CCCCCCCCCCC(C(=O)O)C1(CCC(=O)O1)C(=O)O`
InChIKey	`TUXHHVJPGQUPCF-DYVFJYSZSA-N`

📖 Product Overview

Spiculisporic acid (CAS: 469-77-2) is a chemical compound with molecular formula C17H28O6 and molecular weight 328.4 g/mol. Its IUPAC systematic name is (2S)-2-[(1S)-1-carboxyundecyl]-5-oxooxolane-2-carboxylic acid. LogP 4.4 Topological Polar Surface Area 101.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 6 Rotatable Bonds 12 Exact Mass 328.1886 Heavy Atoms 23 Complexity 419.0 InChI Key: TUXHHVJPGQUPCF-DYVFJYSZSA-N. SMILES: CCCCCCCCCCC(C(=O)O)C1(CCC(=O)O1)C(=O)O.

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