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Size

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Price

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N110186-10mg

10mg

In stock

$236.90

N110186-50mg

50mg

In stock

$1,066.90

Basic Description

Synonyms	Neochlorogenic acid\|906-33-2\|5-O-Caffeoylquinic acid\|Neochlorogenate\|5-Caffeylquinic acid\|(E)-Neochlorogenic Acid\|UNII-O4601UER1Z\|O4601UER1Z\|CHEBI:16384\|trans-Neochlorogenic acid\|EINECS 212-997-1\|(1R,3R,4S,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]ox
Specifications & Purity	≥99%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice

Associated Targets

DHODH Tclin Dihydroorotate dehydrogenase (quinone), mitochondrial 0 Activities

Discover Target: DHODH

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

PTPN1 Tchem Tyrosine-protein phosphatase non-receptor type 1 0 Activities

Discover Target: PTPN1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

HDAC6 Tclin Histone deacetylase 6 0 Activities

Discover Target: HDAC6

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

IUPAC Name	(1R,3R,4S,5R)-3-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy-1,4,5-trihydroxycyclohexane-1-carboxylic acid
INCHI	InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14+,16-/m1/s1
InChi Key	CWVRJTMFETXNAD-NXLLHMKUSA-N
Canonical SMILES	C1C(C(C(CC1(C(=O)O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
Isomeric SMILES	C1[C@H]([C@@H]([C@@H](C[C@]1(C(=O)O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O
WGK Germany	3
PubChem CID	5280633
Molecular Weight	354.31

Certificates

Certificate of Analysis(COA)

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6 results found

Lot Number	Certificate Type	Date	Item
G2322760	Certificate of Analysis	Jul 15, 2023	N110186
G2322763	Certificate of Analysis	Jul 15, 2023	N110186
G2322767	Certificate of Analysis	Jul 15, 2023	N110186
E2325696	Certificate of Analysis	Apr 27, 2023	N110186
B2215605	Certificate of Analysis	Jan 03, 2022	N110186
B2215613	Certificate of Analysis	Jan 03, 2022	N110186

Chemical and Physical Properties

Sensitivity	Light Sensitive,Hygroscopic,Heat Sensitive
Specific Rotation[α]	6.0° (C=0.2,MeOH)

Safety and Hazards(GHS)

Pictogram(s)	GHS07
Signal	Warning
Hazard Statements	H315:Causes skin irritation H319:Causes serious eye irritation H335:May cause respiratory irritation
Precautionary Statements	P261:Avoid breathing dust/fume/gas/mist/vapors/spray. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P405:Store locked up. P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P271:Use only outdoors or in a well-ventilated area. P304+P340:IF INHALED: Remove person to fresh air and keep comfortable for breathing. P403+P233:Store in a well-ventilated place. Keep container tightly closed. P362+P364:Take off contaminated clothing and wash it before reuse. P264+P265:Wash hands [and …] thoroughly after handling. Do not touch eyes. P337+P317:If eye irritation persists: Get medical help. P332+P317:If skin irritation occurs: Get medical help. P319:Get medical help if you feel unwell.
WGK Germany	3

Alternative Products

References

1. Chao-Mei Ma,Takuya Kawahata,Masao Hattori,Toru Otake,Lili Wang,Mohsen Daneshtalab. (2009-12-17) Synthesis, anti-HIV and anti-oxidant activities of caffeoyl 5,6-anhydroquinic acid derivatives.. Bioorganic & medicinal chemistry, 18 ((2)): (863-869). [PMID:20004585]
2. Maria Villarino,Pilar Sandín-España,Paloma Melgarejo,Antonieta De Cal. (2011-03-05) High chlorogenic and neochlorogenic acid levels in immature peaches reduce Monilinia laxa infection by interfering with fungal melanin biosynthesis.. Journal of agricultural and food chemistry, 59 ((7)): (3205-3213). [PMID:21370882]
3. Liangmian Chen,Hideki Hakamata,Fumiyo Kusu,Zhimin Wang,Huimin Gao,Akira Kotani. (2014-03-25) Simultaneous determination of various bioactive redox components in Shuang-Huang-Lian preparations using a novel three-channel isocratic elution liquid chromatography with electrochemical detection system.. Journal of pharmaceutical and biomedical analysis, 95 (93-101). [PMID:24657677]
4. Yanjuan Wang,Jing Wen,Weihua Zheng,Longshan Zhao,Xiaohuan Fu,Zhenzhong Wang,Zhili Xiong,Famei Li,Wei Xiao. (2014-05-21) Simultaneous determination of neochlorogenic acid, chlorogenic acid, cryptochlorogenic acid and geniposide in rat plasma by UPLC-MS/MS and its application to a pharmacokinetic study after administration of Reduning injection.. Biomedical chromatography : BMC, 29 ((1)): (68-74). [PMID:24842397]
5. Jinping Cao,Qing Jiang,Juanying Lin,Xian Li,Chongde Sun,Kunsong Chen. (2014-12-04) Physicochemical characterisation of four cherry species (Prunus spp.) grown in China.. Food chemistry, 173 (855-863). [PMID:25466099]
6. Wen Xu,Mingqing Huang,Huang Li,Xianwen Chen,Yuqin Zhang,Jie Liu,Wei Xu,Kedan Chu,Lidian Chen. (2015-02-25) Chemical profiling and quantification of Gua-Lou-Gui-Zhi decoction by high performance liquid chromatography/quadrupole-time-of-flight mass spectrometry and ultra-performance liquid chromatography/triple quadrupole mass spectrometry.. Journal of chromatography. B, Analytical technologies in the biomedical and life sciences, 986-987 (69-84). [PMID:25710597]
7. Liangmian Chen,Akira Kotani,Fumiyo Kusu,Zhimin Wang,Jingjing Zhu,Hideki Hakamata. (2015-03-07) Quantitative comparison of caffeoylquinic acids and flavonoids in Chrysanthemum morifolium flowers and their sulfur-fumigated products by three-channel liquid chromatography with electrochemical detection.. Chemical & pharmaceutical bulletin, 63 ((1)): (25-32). [PMID:25743191]
8. Fatih Mehmet Yılmaz,Mehmet Karaaslan,Hasan Vardin. (2015-04-22) Optimization of extraction parameters on the isolation of phenolic compounds from sour cherry (Prunus cerasus L.) pomace.. Journal of food science and technology, 52 ((5)): (2851-2859). [PMID:25892783]
9. Boyong Kim,Dong Sook Lee,Hyeong Seok Kim,Taegun Park,Jin Kwan Kim,Suhng Wook Kim,Boo Hyung Lee,Hyun Im Lee,Inyong Kim,Yoonhwa Jeong,Seung Gwan Lee. (2019-03-01) Bioactivity of Fermented Green Coffee Bean Extract Containing High Chlorogenic Acid and Surfactin.. Journal of medicinal food, 22 ((3)): (305-313). [PMID:30817216]
10. Olga Kaltsa,Achillia Lakka,Spyros Grigorakis,Ioanna Karageorgou,Georgia Batra,Eleni Bozinou,Stavros Lalas,Dimitris P Makris. (2020-02-26) A Green Extraction Process for Polyphenols from Elderberry (Sambucus nigra) Flowers Using Deep Eutectic Solvent and Ultrasound-Assisted Pretreatment.. Molecules (Basel, Switzerland), 25 ((4)): [PMID:32093048]
11. Xianan Zhang,Xin Li,Mingshen Su,Jihong Du,Huijuan Zhou,Xiongwei Li,Zhengwen Ye. (2020-11-26) A comparative UPLC-Q-TOF/MS-based metabolomics approach for distinguishing peach (Prunus persica (L.) Batsch) fruit cultivars with varying antioxidant activity.. Food research international (Ottawa, Ont.), 137 (109531-109531). [PMID:33233161]
12. Ki Hyun Kim,Young Ho Kim,Kang Ro Lee. (2007-11-22) Isolation of quinic acid derivatives and flavonoids from the aerial parts of Lactuca indica L. and their hepatoprotective activity in vitro.. Bioorganic & medicinal chemistry letters, 17 ((24)): (6739-6743). [PMID:18029179]
13. Giuliana Noratto,Weston Porter,David Byrne,Luis Cisneros-Zevallos. (2009-06-18) Identifying peach and plum polyphenols with chemopreventive potential against estrogen-independent breast cancer cells.. Journal of agricultural and food chemistry, 57 ((12)): (5219-5226). [PMID:19530711]
14. Faryal Mirza,Joseph Lorenzo,Hicham Drissi,Francis Y Lee,Do Y Soung. (2017-11-18) Dried plum alleviates symptoms of inflammatory arthritis in TNF transgenic mice.. The Journal of nutritional biochemistry, 52 (54-61). [PMID:29149648]
15. Sun Young Park,Mei Ling Jin,Eun Hye Yi,Yoon Kim,Geuntae Park. (2018-06-17) Neochlorogenic acid inhibits against LPS-activated inflammatory responses through up-regulation of Nrf2/HO-1 and involving AMPK pathway.. Environmental toxicology and pharmacology, 62 (1-10). [PMID:29908432]

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Neochlorogenic acid - 99%, high purity , CAS No.906-33-2