Thromboxane B2
Also known as (Z)-7-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]oxan-3-yl]hept-5-enoic acid, 9S,11,15S-trihydroxy-thromboxa-5Z,13E-dien-1-oic acid, (5Z,13E,15S)-9alpha,11,15-trihydroxythromboxa-5,13-dien-1-oic acid
Key facts
What buyers check first
- CAS number
- 54397-85-2
- Formula
- C20H34O6
- Molar mass
- 370.49 g/mol
- EC number
- 637-284-6
- HS code
- 293299
- Category
- Heterocyclic building blocks
What is Thromboxane B2?
Plain description, key identifiers and synonyms
Thromboxane B2 is a member of the class of thromboxanes B that is (5Z,13E)-thromboxa-5,13-dien-1-oic acid substituted by hydroxy groups at positions 9, 11 and 15. It has a role as a mouse metabolite and a human metabolite. It is a conjugate acid of a thromboxane B2(1-).
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (Z)-7-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]oxan-3-yl]hept-5-enoic acid
- CAS number
- 54397-85-2 CAS number cross-checkedOther or deprecated CAS: 63783-09-5
- EC number
- 637-284-6
- Molecular formula
- C20H34O6
- UNII
- V94M3R26ZV
- MDL number
- MFCD00135258
- InChIKey
- XNRNNGPBEPRNAR-JQBLCGNGSA-N
- InChI
- InChI=1S/C20H34O6/c1-2-3-6-9-15(21)12-13-18-16(17(22)14-20(25)26-18)10-7-4-5-8-11-19(23)24/h4,7,12-13,15-18,20-22,25H,2-3,5-6,8-11,14H2,1H3,(H,23,24)/b7-4-,13-12+/t15-,16-,17-,18+,20?/m0/s1
- Canonical SMILES
- CCCCCC(O)C=CC1OC(O)CC(O)C1CC=CCCCC(=O)O
- Isomeric SMILES
- CCCCC[C@@H](/C=C/[C@@H]1[C@H]([C@H](CC(O1)O)O)C/C=C\CCCC(=O)O)O
Synonyms
- (Z)-7-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]oxan-3-yl]hept-5-enoic acid
- 9S,11,15S-trihydroxy-thromboxa-5Z,13E-dien-1-oic acid
- (5Z,13E,15S)-9alpha,11,15-trihydroxythromboxa-5,13-dien-1-oic acid
- Thromboxa-5,13-dien-1-oic acid, 9,11,15-trihydroxy-, (5Z,9alpha,13E,15S)-
- B2, Thromboxane
- 5-Heptenoic acid, 7-(tetrahydro-4,6-dihydroxy-2-(3-hydroxy-1-octenyl)-2H-pyran-3-yl)-, (2R-(2alpha(1E,3S*),3beta(Z),4beta,6alpha))-
- (Z)-7-((2R,3S,4S)-4,6-dihydroxy-2-((E,3S)-3-hydroxyoct-1-enyl)oxan-3-yl)hept-5-enoic acid
- (Z)-7-((2R,3S,4S)-4,6-dihydroxy-2-((S,E)-3-hydroxyoct-1-en-1-yl)tetrahydro-2H-pyran-3-yl)hept-5-enoic acid
- PG Thromboxane B2
- (5Z,13E,15S)-9beta,11,15-Trihydroxythromboxa-5,13-dien-1-oic acid
- (Z)-7-[(2R,3S,4S)-4,6-dihydroxy-2-[(E,3S)-3-hydroxyoct-1-enyl]tetrahydropyran-3-yl]hept-5-enoic acid
- 5-Heptenoic acid, 7-[(2R,3S,4S)-tetrahydro-4,6-dihydroxy-2-[(1E,3S)-3-hydroxy-1-octen-1-yl]-2H-pyran-3-yl]-, (5Z)-rel-
- 5-Heptenoicacid,7-[(2R,3S,4S)-tetrahydro-4,6-dihydroxy-2-[(1E,3S)-3-hydroxy-1-octen-1-yl]-2H-pyran-3-yl]-,(5Z)-rel-
Physical and chemical properties
Measured values and descriptors computed from the structure
Physical and chemical properties
Measured values, check the supplier specification for your grade
No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.
Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.
Computed descriptors
Calculated from the structure, useful for screening and formulation
| Molecular weight | 370.49 g/molcalc.Computed value |
|---|---|
| Exact mass | 370.2355 Dacalc.Computed value |
| LogP (octanol/water) | 2.77calc.Computed value |
| Topological polar surface area | 107.2 Ųcalc.Computed value |
| Hydrogen bond donors | 4calc.Computed value |
| Hydrogen bond acceptors | 5calc.Computed value |
| Rotatable bonds | 12calc.Computed value |
| Heavy atoms | 26calc.Computed value |
| Rings | 1calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.75calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 5calc.Computed value |
| Lipinski rule of five | Passes (0 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Murcko scaffold
The ring system that remains when every side chain is removed
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H361Suspected of damaging fertility or the unborn child.
Precautionary statements (5)
- P203Obtain, read and follow all safety instructions before use.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P318If exposed or concerned, get medical advice.
- P405Store locked up.
- P501Dispose of contents and container in accordance with local regulations.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Full safety data and first aidThromboxane B2 suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- China, NanjingUnclaimed profileThromboxane B2Grade, purity and minimum order on requestPrice on request
- United States, Monmouth JunctionUnclaimed profileThromboxane B2Grade, purity and minimum order on requestPrice on request
- United States, WoburnUnclaimed profileThromboxane B2Grade, purity and minimum order on requestPrice on request
- Germany, LorrachUnclaimed profileThromboxane B2Grade, purity and minimum order on requestPrice on request
- United States, HolbrookUnclaimed profileThromboxane B2Grade, purity and minimum order on requestPrice on request
- China, HangzhouUnclaimed profileThromboxane B2Grade, purity and minimum order on requestPrice on request
- Price on request
- United States, BristolUnclaimed profileThromboxane B2Grade, purity and minimum order on requestPrice on request
- United States, AustinUnclaimed profileThromboxane B2Grade, purity and minimum order on requestPrice on request
- United Kingdom, CambridgeUnclaimed profileThromboxane B2Grade, purity and minimum order on requestPrice on request
Suppliers marked Unclaimed profile have not claimed their profile yet. They are not verified by CompoundList, their offers are price on request and details may have changed, so please confirm them with the supplier. Company representatives can claim a profile with a business email on the company's own website domain. Our team verifies each claim and sends the result by email.
Where suppliers are based
36 suppliers in 9 countries
- United States14
- China10
- United Kingdom3
- Germany2
- Spain2
- Latvia2
- and 3 more countries
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Thromboxane B2 price
Indicative price range per kg from live supplier offers
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Uses and applications
What the substance is used for, by industry and function
Industries and functions
Roles
- animal metabolite
- eukaryotic metabolite
- human metabolite
- mammalian metabolite
- metabolite
- mouse metabolite
Pharmacology
Thromboxane B2 is an eicosanoid and biologically inactive metabolite of thromboxane A2. Thromboxane B2 is released during anaphylaxis. As thromboxane A2 has a short half-life, the levels of thromboxane B2 can be used to indirectly measure the production of thromboxane A2
Regulatory status
Inventories, regulations and trade controls that list this substance
No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.
HS code and trade data
Customs classification and reported world trade statistics
Global trade
World import and export statistics for the HS code Thromboxane B2 is traded under.
Heterocyclic compounds with oxygen hetero-atom(s) only, other
- China28.9%
- Switzerland * partner reported12.7%
- Germany7.8%
- United States49.7%
- China11.9%
- India * partner reported3.3%
* Partner reported figures, a lower bound.
The HS code shown for Thromboxane B2 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Thromboxane B2, based on the data on this page
What is Thromboxane B2?
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What is the molecular formula and weight of Thromboxane B2?
What is Thromboxane B2 used for?
Is Thromboxane B2 hazardous?
What is the HS code of Thromboxane B2?
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What is the price of Thromboxane B2?
Guides for buyers
Practical guides that help when you source, ship or handle Thromboxane B2
- Guide, SafetyHow to read a safety data sheet in 10 minutesA section by section method to pull the essentials out of any 16 section SDS: identity, hazards, composition, storage, PPE, properties, transport and emergency measures.Read
- Guide, SafetyGHS pictograms, signal words and hazard statements explainedA practical guide to the nine GHS pictograms, the signal words Danger and Warning, H and P statements, and how to read a chemical label in seconds.Read
- Guide, Chemical identityCAS registry numbers explainedWhat a CAS number identifies, how the check digit works, why one chemical can have several numbers and what a CAS number cannot tell you about a product.Read
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