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5,8,11,14-Eicosatetraynoic Acid

HCID 1780
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1191-85-1
Standard SMILES
CCCCCC#CCC#CCC#CCC#CCCCC(=O)O
InChIKey
MGLDCXPLYOWQRP-UHFFFAOYSA-N
Molecular formula
C20H24O2
Average molar mass
296.4 g/mol
Monoisotopic mass
296.17763

Overview

Eicosa-5,8,11,14-tetraynoic acid is a long-chain fatty acid.

Names & identifiers

Preferred name
5,8,11,14-Eicosatetraynoic Acid
IUPAC
icosa-5,8,11,14-tetraynoic acid
English name
ETYA
Molecular formula
C20H24O2
Molecular weight
296.4

Names & synonyms

5,8,11,14-eicosatetraynoic acidETYA1191-85-1Ro 3-14285FEJ8J06DRRo 31428DTXSID201523185,8,11,14 Eicosatetraynoic AcidRo 3 1428RefChem:388757DTXCID4074809icosa-5,8,11,14-tetraynoic acid
Show more names
EICOSATETRAYNOIC ACIDRo-3-1428Dry Arachidonic Acid CWSMGLDCXPLYOWQRP-UHFFFAOYSA-NEicosatetraynoic acid(ETYA)5,8,11,14-Icosatetrynoic acidArachidonic Acid(A&A) 10% CWS5,8,11,14-EICOSATETRANOIC ACID
eicosatetranoic acidOctadehydroarachidonic acidOpera_ID_4025,8,11,14-Icosatetraynoic acidSpectrum5_001952BSPBio_001449MLS000069514MFCD00036967

Database identifiers

CAS
1191-85-1
PubChem CID
1780
DTXSID
DTXSID20152318
ChEMBL
CHEMBL458328
ChEBI
CHEBI:94483

Properties

Computed structural properties

XLogP
5.3
Topological polar surface area
37.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
22
Formal charge
0
Complexity
586

Experimental & physicochemical properties

LipidsFatty Acyls [FA] -> Fatty Acids and Conjugates [FA01] -> Unsaturated fatty acids [FA0103]

Physicochemical properties

Melting point
79 · 79-81 °C
Boiling point
490.3 · 490.3±45.0 °C(Predicted)
Density
1.034 · 1.034±0.06 g/cm3(Predicted)
storage temp.
-20 °C · -20°C
solubility
10 mg/ml · ≤10mg/ml in ethanol;100mg/ml in DMSO;100mg/ml in dimethyl formamide
form
Off-white solid
pka
4.61 · 4.61±0.10(Predicted)
color
Light yellow to brown
biological source
synthetic (organic)
BRN
1798411 · 1798411
InChI
1S/C20H24O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h2-5,8,11,14,17-19H2,1H3,(H,21,22)
InChIKey
MGLDCXPLYOWQRP-UHFFFAOYSA-N

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

F
8-10
PPE
Eyeshields, Gloves, type N95 (US)
wgk
3
safety_code
22-24/25
Storage Class
11 - Combustible Solids

Chemistry & industry

Applications

UsesETYA is a Cox, LO, and PLA2 inhibitor.

Upstream & downstream products

Downstream products

Arachidonic acid

Suppliers33 total

成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
湖北海克斯生化有限公司17362916295; 17362916295 · [email protected]
Aladdin Scientific[email protected]
Syntechem Co.,Ltd[email protected]
湖北魏氏化学试剂股份有限公司027-59102966 18717199209 · [email protected]
MedBio脉铂医药021-69568360 18916172912 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
广州爱纯医药科技有限公司020-39119399 18927568969 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]

Related reactions

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New reaction record

No reaction records under the current filter.

Compound notes

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On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
UNII
5FEJ8J06DR
Nikkaji
J353.502I
SMILES
CCCCCC#CCC#CCC#CCC#CCCCC(O)=O
FDA UNII
5 FEJ8J06DR · 5FEJ8J06DR
UNSPSC Code
12352200 · 12352200
NACRES
77 · NA.77
PPE
95 · Eyeshields, Gloves, type N95 (US)
Safety Statements
22 · 22-24/25
WGK Germany
3 · 3
F
8 · 8-10
Storage Class
11 · 11 - Combustible Solids
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海波以尔化工有限公司021-50182298 021-50180596 · [email protected]
BOC Sciences16314854226; +8616314854226 · [email protected]
湖北恒绿源科技有限公司027-88188016 18717196322 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
湖北辰心化工有限公司17362916295 · [email protected]
南通全益生物科技有限公司0513-66337626 18051384581 · [email protected]
BOC Sciences16314854226 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
山东亚图生物科技有限公司0531-55555418 15301096991 · [email protected]
安泰精细化工技术有限公司18503026267 · [email protected]
威尔曼医药集团有限公司15807197853 18971451745 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
深圳市丽晶生化科技有限公司0755-85201366 18938635012 · [email protected]
上海吉至生化科技有限公司021-4009004166/18616739031 18616739031 · [email protected]
TargetMol中国(陶术生物)4008200310 15002144251 · [email protected]
ChemeGen 中国18818260767 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
湖北成丰化工有限公司15827338311 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]
陕西缔都化学有限公司17691182729 17392216275 · [email protected]

Additional notes

DefinitionChEBI: Eicosa-5,8,11,14-tetraynoic acid is a long-chain fatty acid.