Methyl (1S,3R,4S,5R)-4-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,3,5-trihydroxycyclohexane-1-carboxylate, ≥95%, ≥95%

cas: 123372-74-7 — zobacz wszystkie produkty o tym numerze CAS, także pod innymi nazwami

Methyl (1S,3R,4S,5R)-4-(((E)-3-(3,4-dihydroxyphenyl)acryloyl)oxy)-1,3,5-trihydroxycyclohexane-1-carboxylate, ≥95%, ≥95% (CAS 123372-74-7) to odczynnik chemiczny dostępny w ofercie Chemat. Dostępne opakowania: 20mg. Oferty producentów: Chemat.

• 2D
• 3D

Trans-methyl (3R,5R)-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,3,5-trihydroxycyclohexane-1-carboxylate (CAS 123372-74-7) to związek chemiczny o wzorze sumarycznym C17H20O9 i masie molowej 368.3 g/mol. Nazwa systematyczna IUPAC: trans-methyl (3R,5R)-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,3,5-trihydroxycyclohexane-1-carboxylate. InChIKey: SMFKCIHIAHWGGL-JUEQGWKHSA-N.

Dane identyfikacyjne

Wzór sumaryczny	C17H20O9
Masa molowa	368.3 g/mol
Nazwa IUPAC	trans-methyl (3R,5R)-4-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,3,5-trihydroxycyclohexane-1-carboxylate
InChIKey	SMFKCIHIAHWGGL-JUEQGWKHSA-N
SMILES	COC(=O)C1(C[C@H](C([C@@H](C1)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O

Dane obliczone przez PubChem (NCBI)

Synonimy: Methyl 4-caffeoylquinate, Methyl 4-O-caffeoylquinate, 4-O-Caffeoylquinic acid methyl ester, Cryptochlorogenic acid methyl ester, methyl-4-O-caffeoylquinate, orb1682129, 4-caffeoylquinic acid methyl ester, 4-O-trans-caffeoylquinic acid methyl ester

Izomery (ten sam wzór sumaryczny)

(1R,3R,4S,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid C₁₇H₂₀O₉

(1R,3R,4S,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid C₁₇H₂₀O₉

(1S,3R,4R,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid C₁₇H₂₀O₉

methyl (1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylate C₁₇H₂₀O₉

trans-(3R,5R)-1,3,5-trihydroxy-4-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid C₁₇H₂₀O₉

(1S,3R,4R,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-4,5-dihydroxy-1-methoxycyclohexane-1-carboxylic acid C₁₇H₂₀O₉

methyl (1R,3R,4S,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylate C₁₇H₂₀O₉

methyl (1S,3R,4R,5R)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexane-1-carboxylate C₁₇H₂₀O₉

(1S,3R,4R,5R)-1,3,4-trihydroxy-5-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid C₁₇H₂₀O₉

trans-(3R,5R)-1,3,5-trihydroxy-4-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxycyclohexane-1-carboxylic acid C₁₇H₂₀O₉