Carvonic acid: Difference between revisions

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Revision as of 13:29, 12 May 2011 editCheMoBot (talk \| contribs)Bots141,565 edits Updating {{chembox}} (no changed fields - added verified revid - updated 'UNII_Ref', 'ChemSpiderID_Ref', 'StdInChI_Ref', 'StdInChIKey_Ref', 'ChEMBL_Ref', 'KEGG_Ref') per Chem/Drugbox validation (← Previous edit		Latest revision as of 12:23, 27 June 2019 edit undoEdgar181 (talk \| contribs)Extended confirmed users196,325 edits removed Category:Ketones; added Category:Enones using HotCat
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	{{~~chembox~~		{{Chembox
			\| Verifiedfields = changed
⚫	\| verifiedrevid = ~~388072095~~
			\| Watchedfields = changed
		⚫	\| verifiedrevid = 428751289
	\| ImageFile = Carvonic acid.svg		\| ImageFile = Carvonic acid.svg
	\| ImageSize = 200px
	\| IUPACName = 2-(4-Methyl-5-oxo-cyclohex-3-enyl)-acrylic acid		\| IUPACName = 2-(4-Methyl-5-oxo-cyclohex-3-enyl)-acrylic acid
	\| OtherNames =		\| OtherNames =
	\| Section1 = {{Chembox Identifiers		\|Section1={{Chembox Identifiers
			\| CASNo_Ref = {{cascite\|correct\|??}}
	\| CASNo = 362483-06-5		\| CASNo = 362483-06-5
	\| CASNo_Comment = (racemate)		\| CASNo_Comment = (racemate)
		⚫	\| SMILES = CC1=CC(CC1=O)C(=C)C(=O)O
⚫	\| PubChem =
			\| SMILES_Comment = (R)
⚫	\| SMILES = O=~~C1CC(~~C(~~C(O)~~=O)=C)CC=~~C1C~~
			\| ChemSpiderID_Ref = {{chemspidercite\|changed\|chemspider}}
⚫	}}
			\| ChemSpiderID = 27330306
⚫	\| Section2 = {{Chembox Properties
			\| ChemSpiderID_Comment = (R)
			\| StdInChI_Ref = {{stdinchicite\|changed\|chemspider}}
			\| StdInChI = 1S/C10H12O3/c1-6-3-4-8(5-9(6)11)7(2)10(12)13/h3,8H,2,4-5H2,1H3,(H,12,13)/t8-/m1/s1
			\| StdInChI_Comment = (R)
			\| StdInChIKey_Ref = {{stdinchicite\|changed\|chemspider}}
			\| StdInChIKey = BPJKNHQCPHBIAR-MRVPVSSYSA-N
			\| ChemSpiderID1_Ref = {{chemspidercite\|changed\|chemspider}}
			\| ChemSpiderID1 = 27330305
			\| ChemSpiderID1_Comment = (S)
		⚫	\| PubChem = 71308172
			\| SMILES1 = CC1=CC(CC1=O)C(=C)C(=O)O
			\| SMILES1_Comment = (S)
			\| InChI3 = 1S/C10H12O3/c1-6-3-4-8(5-9(6)11)7(2)10(12)13/h3,8H,2,4-5H2,1H3,(H,12,13)/t8-/m0/s1
			\| InChI3_Comment = (S)
			\| InChIKey3 = BPJKNHQCPHBIAR-QMMMGPOBSA-N
		⚫	}}
		⚫	\|Section2={{Chembox Properties
	\| Formula = C<sub>10</sub>H<sub>12</sub>O<sub>3</sub>		\| Formula = C<sub>10</sub>H<sub>12</sub>O<sub>3</sub>
	\| MolarMass = 180.20 g/mol		\| MolarMass = 180.20 g/mol
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	\| MeltingPt =		\| MeltingPt =
	\| BoilingPt =		\| BoilingPt =
	\| Solubility = }}		\| Solubility =
			}}
	\| Section3 = {{Chembox Hazards		\|Section3={{Chembox Hazards
	\| MainHazards =		\| MainHazards =
	\| FlashPt =		\| FlashPt =
			\| AutoignitionPt =
	\| Autoignition = }}
			}}
	}}		}}

	'''Carvonic acid''', or α-methylene-4-methyl-5-oxo-3-cyclohexene-1-acetic acid, is a ] formed by metabolism of ] in humans.<ref>{{cite journal		'''Carvonic acid''', or α-methylene-4-methyl-5-oxo-3-cyclohexene-1-acetic acid, is a ] formed by metabolism of ] in humans.<ref>{{cite journal\| author = Engel, W. \| title = In Vivo Studies on the Metabolism of the Monoterpenes ''S''-(+)- and ''R''-(−)-Carvone in Humans Using the Metabolism of Ingestion-Correlated Amounts (MICA) Approach \| journal = J. Agric. Food Chem.\| year = 2001\| volume = 49\| issue = 8\| pages = 4069–4075\| doi = 10.1021/jf010157q\| pmid=11513712}}</ref>
	\| author = Engel, W.
	\| title = In Vivo Studies on the Metabolism of the Monoterpenes ''S''-(+)- and ''R''-(-)-Carvone in Humans Using the Metabolism of Ingestion-Correlated Amounts (MICA) Approach
	\| journal = J. Agric. Food Chem.
	\| year = 2001
	\| volume = 49
	\| issue = 8
	\| pages = 4069–4075
	\| doi = 10.1021/jf010157q}}</ref>

	==References==		==References==
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	]		]
	]		]
	]		]
			]

Latest revision as of 12:23, 27 June 2019

Carvonic acid
Names

IUPAC name 2-(4-Methyl-5-oxo-cyclohex-3-enyl)-acrylic acid
Identifiers
CAS Number	362483-06-5 (racemate)
3D model (JSmol)	(R): Interactive image (S): Interactive image
ChemSpider	27330306 (R) 27330305 (S)
PubChem CID	71308172
CompTox Dashboard (EPA)	DTXSID10745430
InChI InChI=1S/C10H12O3/c1-6-3-4-8(5-9(6)11)7(2)10(12)13/h3,8H,2,4-5H2,1H3,(H,12,13)/t8-/m1/s1Key: BPJKNHQCPHBIAR-MRVPVSSYSA-N (S): InChI=1S/C10H12O3/c1-6-3-4-8(5-9(6)11)7(2)10(12)13/h3,8H,2,4-5H2,1H3,(H,12,13)/t8-/m0/s1Key: BPJKNHQCPHBIAR-QMMMGPOBSA-N
SMILES (R): CC1=CC(CC1=O)C(=C)C(=O)O (S): CC1=CC(CC1=O)C(=C)C(=O)O
Properties
Chemical formula	C₁₀H₁₂O₃
Molar mass	180.20 g/mol
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). N verify (what is ?) Infobox references

Chemical compound

Carvonic acid, or α-methylene-4-methyl-5-oxo-3-cyclohexene-1-acetic acid, is a terpenoid formed by metabolism of carvone in humans.

References

Engel, W. (2001). "In Vivo Studies on the Metabolism of the Monoterpenes S-(+)- and R-(−)-Carvone in Humans Using the Metabolism of Ingestion-Correlated Amounts (MICA) Approach". J. Agric. Food Chem. 49 (8): 4069–4075. doi:10.1021/jf010157q. PMID 11513712.

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