Structural formula of 9(S),12(S),13(S)-Trihydroxy-10(E)-octadecenoic acid

9(S),12(S),13(S)-Trihydroxy-10(E)-octadecenoic acid

Product number: 14-1872
CAS number: 97134-11-7
Synonyms: (9S,10E,12S,13S)-9,12,13-Trihydroxy-10-octadecenoic acid, (9S,12S,13S)-Pinellic acid, (-)-Pinellic acid, ZINC 12496469, (9S,10E,12S,13S)-(-)-9,12,13-trihydroxy-10-Octadecenoic acid, 10-Octadecenoic acid, 9,12,13-trihydroxy-, [9S-(9R*,10E,12R*,13R*)]-, Pinellic acid

Identifiers

CAS Index Name: 10-Octadecenoic acid, 9,12,13-trihydroxy-, (9S,10E,12S,13S)-
Molecular formula: C18H34O5
Molecular weight: 330.46
Smiles: O=C(O)CCCCCCCC(O)C=CC(O)C(O)CCCCC
Isomeric Smiles: C(C(C(CCCCC)O)O)=CC(CCCCCCCC(O)=O)O
InChI: InChI=1S/C18H34O5/c1-2-3-7-11-16(20)17(21)14-13-15(19)10-8-5-4-6-9-12-18(22)23/h13-17,19-21H,2-12H2,1H3,(H,22,23)/b14-13+/t15-,16-,17-/m0/s1
InChIKey: InChIKey=MDIUMSLCYIJBQC-MVFSOIOZSA-N

Product information

Purity: >98%
Storage: Freezer
Supplied as: In solution
Physical state: Liquid
Documentation: Certificate of Analysis
MSDS: Download

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14-1872-19(S),12(S),13(S)-Trihydroxy-10(E)-octadecenoic acid - 1 mg
14-1872-399(S),12(S),13(S)-Trihydroxy-10(E)-octadecenoic acid - 100 ug299.00 €
14-1872-409(S),12(S),13(S)-Trihydroxy-10(E)-octadecenoic acid - 5 x 100 ug

Citations