(1α,3R,4α,5R)-1-((3-(3,4-Dihydroxyphenyl)acryloyl)oxy)-3,4,5-trihydroxycyclohexane-1-carboxylic acid, 98%

cas: 1241-87-8 — zobacz wszystkie produkty o tym numerze CAS, także pod innymi nazwami

(1α,3R,4α,5R)-1-((3-(3,4-Dihydroxyphenyl)acryloyl)oxy)-3,4,5-trihydroxycyclohexane-1-carboxylic acid, 98% (CAS 1241-87-8) to odczynnik chemiczny dostępny w ofercie Chemat. Dostępne opakowania: 1mg. Oferty producentów: Chemat.

• 2D
• 3D

Trans-(3R,5R)-1-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4,5-trihydroxycyclohexane-1-carboxylic acid (CAS 1241-87-8) to związek chemiczny o wzorze sumarycznym C16H18O9 i masie molowej 354.31 g/mol. Nazwa systematyczna IUPAC: trans-(3R,5R)-1-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4,5-trihydroxycyclohexane-1-carboxylic acid. InChIKey: GWTUHAXUUFROTF-AVXJPILUSA-N.

Dane identyfikacyjne

Wzór sumaryczny	C16H18O9
Masa molowa	354.31 g/mol
Nazwa IUPAC	trans-(3R,5R)-1-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-3,4,5-trihydroxycyclohexane-1-carboxylic acid
InChIKey	GWTUHAXUUFROTF-AVXJPILUSA-N
SMILES	C1[C@H](C([C@@H](CC1(C(=O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O)O

Dane obliczone przez PubChem (NCBI)

Synonimy: Npc233393, 1-Caffeoylquinic acid, 1-O-caffeoylquinic acid, trans-1-o-Caffeoylquinic acid, 1-Cqa, 1-O-Caffeoyl quinic acid, 1-O-caffeoyl-quinic acid, Quinic acid, 1-caffeoyl-, orb1218996, orb1297584

Izomery (ten sam wzór sumaryczny)

trans-(3R,5R)-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,3,5-trihydroxycyclohexane-1-carboxylic acid C₁₆H₁₈O₉

(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid C₁₆H₁₈O₉

(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid C₁₆H₁₈O₉

bis(3,5-dihydroxy-4-methylbenzoic acid);hydrate C₁₆H₁₈O₉

6-methoxy-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one C₁₆H₁₈O₉

(1R,3R,4S,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid C₁₆H₁₈O₉

5,7-dihydroxy-2-methyl-6-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one C₁₆H₁₈O₉

5-hydroxy-2-methyl-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one C₁₆H₁₈O₉

7-methoxy-6-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one C₁₆H₁₈O₉

5,7-dihydroxy-2-methyl-8-[(2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]chromen-4-one C₁₆H₁₈O₉

4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,3,5-trihydroxycyclohexane-1-carboxylic acid C₁₆H₁₈O₉

3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid C₁₆H₁₈O₉