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Key Documents

05616

Sigma-Aldrich

3-脱氢莽草酸

≥95.0% (HPLC)

同義詞:

(4S,5R) -(-)-4,5-二羟基-3-氧代-1-环己烯-1-羧酸, 3-DHS, 5-脱氢莽草酸

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About This Item

經驗公式(希爾表示法):
C7H8O5
CAS號碼:
分子量::
172.14
MDL號碼:
分類程式碼代碼:
12352106
PubChem物質ID:
NACRES:
NA.25

品質等級

化驗

≥95.0% (HPLC)

形狀

powder

光學活性

[α]/D -59.0±3.0°, c = 1 in ethanol

顏色

white to off-white

儲存溫度

2-8°C

SMILES 字串

O[C@@H]1CC(=CC(=O)[C@H]1O)C(O)=O

InChI

1S/C7H8O5/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1,5-6,9-10H,2H2,(H,11,12)/t5-,6-/m1/s1

InChI 密鑰

SLWWJZMPHJJOPH-PHDIDXHHSA-N

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應用

3-脱氢莽草酸是在儿茶酸合成中由D-葡萄糖生成的生化中间体。3-脱氢莽草酸已用于利用D-葡萄糖衍生的β-酮酯对儿茶酸(1)和2,4,5-三羟基苯甲酸乙酯(2)进行合成的研究中。3-脱氢莽草酸也已用于评估莽草生物合成途径,以开发无毒抗菌剂、除草剂和抗寄生虫药物。

生化/生理作用

莽草酸途径的代谢物,具有适于连续分光光度测定的发色团。微生物中芳香代谢物的前体。

象形圖

Exclamation mark

訊號詞

Warning

危險聲明

危險分類

Eye Irrit. 2

儲存類別代碼

11 - Combustible Solids

水污染物質分類(WGK)

WGK 3

閃點(°F)

Not applicable

閃點(°C)

Not applicable

個人防護裝備

dust mask type N95 (US), Eyeshields, Gloves


分析證明 (COA)

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