[1R-(1α,3α,4α,5β)]-3-[[3-(3,4-Dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexancarbonsure
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- CAS-Nr.
- 906-33-2
- Bezeichnung:
- [1R-(1α,3α,4α,5β)]-3-[[3-(3,4-Dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexancarbonsure
- Englisch Name:
- Neochlorogenic acid
- Synonyma:
- 5-Caffeoylquinic acid;Neochlorogenate;Nochlorogenic acid;5-O-CAFFEOYLQUINICACID;5-Dicaffeoylquinic Acid;(1R,3R,4S,5R)-5-[(E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy-1,3,4-trihydroxycyclohexane-1-carboxylic acid;[1R-(1alpha,3alpha,4alpha,5beta)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid;Einecs 212-997-1;Neochlorogenic aci;Neochlorogenic acid
- CBNumber:
- CB0914996
- Summenformel:
- C16H18O9
- Molgewicht:
- 354.31
- MOL-Datei:
- 906-33-2.mol
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[1R-(1α,3α,4α,5β)]-3-[[3-(3,4-Dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexancarbonsure Eigenschaften
- Schmelzpunkt:
- 204-206 °C (decomp)
- Siedepunkt:
- 665.0±55.0 °C(Predicted)
- Dichte
- 1.65±0.1 g/cm3(Predicted)
- storage temp.
- 2-8°C
- L?slichkeit
- DMSO (Slightly), Ethanol (Slightly, Heated, Sonicated)
- Aggregatzustand
- Solid
- pka
- 3.90±0.50(Predicted)
- Farbe
- White to Off-White
- Stabilit?t:
- Hygroscopic
- InChIKey
- CWVRJTMFETXNAD-NXLLHMKUSA-N
- LogP
- 0.370 (est)
- CAS Datenbank
- 906-33-2
Sicherheit
- Risiko- und Sicherheitserkl?rung
- Gefahreninformationscode (GHS)
| WGK Germany |
3 |
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| HS Code |
29182900 |
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| Bildanzeige (GHS) |
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| Alarmwort |
Warnung |
| Gefahrenhinweise |
| Code |
Gefahrenhinweise |
Gefahrenklasse |
Abteilung |
Alarmwort |
Symbol |
P-Code |
| H302 |
Gesundheitssch?dlich bei Verschlucken. |
Akute Toxizit?t oral |
Kategorie 4 |
Warnung |
![GHS hazard pictograms]() src="/GHS07.jpg" width="20" height="20" /> |
P264, P270, P301+P312, P330, P501 |
| H315 |
Verursacht Hautreizungen. |
Hautreizung |
Kategorie 2 |
Warnung |
![GHS hazard pictograms]() src="/GHS07.jpg" width="20" height="20" /> |
P264, P280, P302+P352, P321,P332+P313, P362 |
| H319 |
Verursacht schwere Augenreizung. |
Schwere Augenreizung |
Kategorie 2 |
Warnung |
![GHS hazard pictograms]() src="/GHS07.jpg" width="20" height="20" /> |
P264, P280, P305+P351+P338,P337+P313P |
| H335 |
Kann die Atemwege reizen. |
Spezifische Zielorgan-Toxizit?t (einmalige Exposition) |
Kategorie 3 (Atemwegsreizung) |
Warnung |
![GHS hazard pictograms]() src="/GHS07.jpg" width="20" height="20" /> |
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| Sicherheit |
| P261 |
Einatmen von Staub vermeiden. |
| P280 |
Schutzhandschuhe/Schutzkleidung/Augenschutz tragen. |
| P301+P312 |
BEI VERSCHLUCKEN: Bei Unwohlsein GIFTINFORMATIONSZENTRUM/Arzt/... (geeignete Stelle für medizinische Notfallversorgung vom Hersteller/Lieferanten anzugeben) anrufen. |
| P302+P352 |
BEI BERüHRUNG MIT DER HAUT: Mit viel Wasser/... (Hersteller kann, falls zweckm??ig, ein Reinigungsmittel angeben oder, wenn Wasser eindeutig ungeeignet ist, ein alternatives Mittel empfehlen) waschen. |
| P305+P351+P338 |
BEI KONTAKT MIT DEN AUGEN: Einige Minuten lang behutsam mit Wasser spülen. Eventuell vorhandene Kontaktlinsen nach M?glichkeit entfernen. Weiter spülen. |
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[1R-(1α,3α,4α,5β)]-3-[[3-(3,4-Dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexancarbonsure Chemische Eigenschaften,Einsatz,Produktion Methoden
Verwenden
(E)-Neochlorogenic Acid is an antioxidant compound used in the treatment of oxidative stress and related afflictions.
Definition
ChEBI: A cinnamate ester obtained by formal condensation of the carboxy group of trans-caffeic acid with the 5-hydroxy group of quinic acid.
Allgemeine Beschreibung
This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG
[1R-(1α,3α,4α,5β)]-3-[[3-(3,4-Dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexancarbonsure Upstream-Materialien And Downstream Produkte
Upstream-Materialien
Downstream Produkte
[1R-(1α,3α,4α,5β)]-3-[[3-(3,4-Dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexancarbonsure Anbieter Lieferant Produzent Hersteller Vertrieb H?ndler.
Global( 235)Lieferanten
906-33-2([1R-(1α,3α,4α,5β)]-3-[[3-(3,4-Dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexancarbonsure)Verwandte Suche:
Quinine sulfate dihydrate
6'-Methoxy-cinchonan-9-ol, (9S)
ACETIC ACID
(2E,4E)-Undeca-2,4-dienal
5-O-(3,4-Dihydroxycinnamoyl)-L-chinasure
Glycin
Folsure
Zitronensure
ASCORBICACID
Chinin
1,3,4,5-Tetrahydroxycyclohexancarbonsure
ISOCHLOROGENIC ACID(PLEASE CALL)(P)
[1R-(1α,3α,4α,5β)]-3-[[3-(3,4-Dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexancarbonsure
phosphoric acid
- Neochlorogenic acid
- trans-5-O-Caffeoyl-D-quinate
- Neochlorogenic acid，5-Caffeoylquinic acid，trans-5-O-Caffeoyl-D-quinate
- (1R)-3β-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1β,4β,5α-trihydroxycyclohexane-1α-carboxylic acid
- 1,3β,4α-Trihydroxy-5α-[3-(3,4-dihydroxyphenyl)acryloyloxy]cyclohexane-1β-carboxylic acid
- Neochlorogenic aci
- Neochlorogenic acid(3')
- 5-O-(trans-3,4-Dihydroxycinnamoyl)-D-quinic acid
- trans-5-O-Caffeoylquinic acid
- Cryptochlorogenic acid
5-Caffeoylquinic acid
- 5-Caffeoylquinic acid/Neochlorogenic acid
- NEOCHLOROGENIC ACID FROM LONICERA J
- NEOCHLOROGENIC ACID FROM LONICERA JA
- (E)-Neochlorogenic Acid
- trans-5-O-caffeoyl-D-quinic acid
- 1,3β,4α-Trihydroxy-5α-[3-(3,4-dihydroxyphenyl)propenoyloxy]cyclohexane-1β-carboxylic acid
- 3β-[3-(3,4-Dihydroxyphenyl)propenoyloxy]-1,4β,5α-trihydroxycyclohexane-1α-carboxylic acid
- 5α-[3-(3,4-Dihydroxyphenyl)acryloyloxy]-1,3β,4α-trihydroxycyclohexane-1β-carboxylic acid
- (1R)-1α,3α,4α-Trihydroxy-5β-[[3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1β-cyclohexanecarboxylic acid
- 5β-[[3-(3,4-Dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1α,3α,4α-trihydroxycyclohexanecarboxylic acid
- (1R-(1alpha,3alpha,4alpha,5beta))-3-((3-(3,4-Dihydroxyphenyl)-1-oxoallyl)oxy)-1,4,5-trihydroxycyclohexanecarboxylic acid
- Cyclohexanecarboxylic acid, 3-((3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl)oxy)-1,4,5-trihydroxy-, (1R-(1alpha,3alpha,4alpha,5beta))-
- Einecs 212-997-1
- Neochlorogenic acid (trans-5-O-Caffeoylquinic acid)
- 3-{[3-(3,4-Dihydroxyphenyl)acryloyl]oxy}-1,4,5-trihydroxycyclohexanecarboxylic acid
- [1R-(1α,3α,4α,5β)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid
- Cyclohexanecarboxylic acid, 3-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propen-1-yl]oxy]-1,4,5-trihydroxy-, (1R,3R,4S,5R)-
- Neochlorogenic acid
5-Caffeoylquinic acid
- Neochlorogenic acid USP/EP/BP
- [1R-(1α,3α,4α,5β)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoally...
- [1R-(1α,3α,4α,5β)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid
- Cyclohexanecarboxylic acid,3-[[(2E)-3-(3,4-dihydroxyphenyl)-1-oxo-2-propenyl]oxy]-1,4,5-trihydroxy-,(1R,3R,4S,5R)-
- 4-Trihydroxyanthraquinone
- [1R-(1alpha,3alpha,4alpha,5beta)]-3-[[3-(3,4-dihydroxyphenyl)-1-oxoallyl]oxy]-1,4,5-trihydroxycyclohexanecarboxylic acid
- 5-O-CAFFEOYLQUINICACID
- 5-Caffeoylquinic acid
- 5-Dicaffeoylquinic Acid
- Neochlorogenate
- Nochlorogenic acid
- (1R,3R,4S,5R)-5-[(E)-3-(3,4-Dihydroxyphenyl)prop-2-enoyl]oxy-1,3,4-trihydroxycyclohexane-1-carboxylic acid
- Neochlorogenic acid (6CI, 8CI)
- Neochlorogenic acid in Methanol
- Neochlorogenic acid-RM
- 906-33-2
- chemical reagent
- pharmaceutical intermediate
- phytochemical
- reference standards from Chinese medicinal herbs (TCM).
- standardized herbal extract
