AG003UEZ

Name: (αS,2S)-2-Carboxy-α-decyltetrahydro-5-oxo-2-furanacetic acid
Brand: Angene Chemical
SKU: AG003UEZ

469-77-2 | (αS,2S)-2-Carboxy-α-decyltetrahydro-5-oxo-2-furanacetic acid

AG003UEZ

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CAS Number	469-77-2
Catalog Number	AG003UEZ(AGN-PC-0RUQYM)
Chemical Name	(αS,2S)-2-Carboxy-α-decyltetrahydro-5-oxo-2-furanacetic acid
IUPAC Name	2-(1-carboxyundecyl)-5-oxooxolane-2-carboxylic acid
InChI	InChI=1S/C17H28O6/c1-2-3-4-5-6-7-8-9-10-13(15(19)20)17(16(21)22)12-11-14(18)23-17/h13H,2-12H2,1H3,(H,19,20)(H,21,22)
InChI Key	TUXHHVJPGQUPCF-UHFFFAOYSA-N
MDL Number	MFCD00059059
Molecular Formula	C17H28O6
Molecular Weight	328.4006
NSC Number	244387
SMILES	C(=O)(O)[C@@]1(OC(CC1)=O)[C@@H](C(=O)O)CCCCCCCCCC
Synonyms	Spiculisporic acid, 4,5-Dicarboxy-gamma-pentadecanolactone, Spiculesporic acid, 469-77-2, MLS003115257, 4,5-dicarboxy-4-pentadecanolide, NSC244387, spiculisporic-acid, AC1L7TTZ, SCHEMBL3146152, CHEMBL2007424, TUXHHVJPGQUPCF-UHFFFAOYSA-N, ACM469772, MFCD00059059, NSC-244387, NCI60_001952, SMR001830839, D1963, FT-0702758, C-46396, 2-Carboxy-alpha-decyl-5-oxotetrahydrofuran-2-acetic acid, 2-(1-Carboxyundecyl)-5-oxotetrahydro-2-furancarboxylic acid #, 2-(1-carboxyundecyl)-5-oxotetrahydrofuran-2-carboxylic acid, 2-(1-hydroxy-1-oxododecan-2-yl)-5-oxooxolane-2-carboxylic acid, 65759-98-0, Metheptazine, C17H28O6, CID316426, C17-H28-O6, NSC 244387, 2-Furanacetic acid, 2-carboxy-alpha-decyltetrahydro-5-oxo-, (S-(R,R))-2-Carboxy-alpha-decyltetrahydro-5-oxo-2-furanacetic acid, 2-Furanacetic acid, 2-carboxy-alpha-decyltetrahydro-5-oxo-, (S-(R,R))-,

Complexity	419
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	328.189g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	328.405g/mol
Monoisotopic Mass	328.189g/mol
Rotatable Bond Count	12
Topological Polar Surface Area	101A^2
Undefined Atom Stereocenter Count	2
Undefined Bond Stereocenter Count	0
XLogP3	4.4

GHS Hazard and Precautionary Statements

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited