Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, monopotassium salt, [1S-(1alpha,3beta,4alpha,5alpha)]-, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1) (CAS 7509-32-2) — formula C24H27KN4O11, molecular weight 586.6; category organic chemicals.
| CAS Number | 7509-32-2 |
|---|---|
| Molecular Formula | C24H27KN4O11 |
| Molecular Weight | 586.6 |
| Category | Organic Chemicals |
Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, monopotassium salt, [1S-(1alpha,3beta,4alpha,5alpha)]-, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1) is a carbon-based organic compound with CAS registry number 7509-32-2 and molecular formula C24H27KN4O11 (molecular weight 586.6), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 7509-32-2
Its molecular formula C24H27KN4O11 comprises 24 C, 27 H, 1 K, 4 N, 11 O atoms.
Also known as: Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, monopotassium salt, [1S-(1alpha,3beta,4alpha,5alpha)]-, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1) · 环己烷甲酸，3-[[3-(3,4-二羟基苯基)-1-氧代-2-丙烯基]氧基]-1,4,5-三羟基-单钾盐，[1S-(1α,3β,4α,5α)]-，化合物。与 3,7-二氢-1,3,7-三甲基-1H-嘌呤-2,6-二酮 (1:1)
Category: organic chemicals
The CAS registry number of Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, monopotassium salt, [1S-(1alpha,3beta,4alpha,5alpha)]-, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1) is 7509-32-2.
Molecular formula C24H27KN4O11, molecular weight 586.6.
It is also registered under: Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, monopotassium salt, [1S-(1alpha,3beta,4alpha,5alpha)]-, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1), 环己烷甲酸，3-[[3-(3,4-二羟基苯基)-1-氧代-2-丙烯基]氧基]-1,4,5-三羟基-单钾盐，[1S-(1α,3β,4α,5α)]-，化合物。与 3,7-二氢-1,3,7-三甲基-1H-嘌呤-2,6-二酮 (1:1).
Category: Organic Chemicals.
Independent reference data for Cyclohexanecarboxylic acid, 3-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-, monopotassium salt, [1S-(1alpha,3beta,4alpha,5alpha)]-, compd. with 3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione (1:1) (CAS 7509-32-2), compiled from public chemistry databases.
| CAS 号 | 7509-32-2 |
|---|---|
| PubChem CID | 23678000 |
| 分子式 | C24H27KN4O11 |
| IUPAC 名称 | potassium;(1S,3R,4R,5R)-3-[3-(3,4-dihydroxyphenyl)prop-2-enoyloxy]-1,4,5-trihydroxycyclohexane-1-carboxylate;1,3,7-trimethylpurine-2,6-dione |
| Molecular Weight | 586.6 |
|---|---|
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 12 |
| Rotatable Bond Count | 5 |
| Exact Mass | 586.13133917 |
| Monoisotopic Mass | 586.13133917 |
| Topological Polar Surface Area | 226 |
| Heavy Atom Count | 40 |
Chlorogenic acid, monopotassium salt, compd with caffeine (1:1); DTXSID80635531; EINECS 231-366-1; NSC 407298; 102735-66-0
环己烷甲酸，3-[[3-(3,4-二羟基苯基)-1-氧代-2-丙烯基]氧基]-1,4,5-三羟基-单钾盐，[1S-(1α,3β,4α,5α)]-，化合物。与 3,7-二氢-1,3,7-三甲基-1H-嘌呤-2,6-二酮 (1:1) · CAS 7509-32-2 · C24H27KN4O11.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.