Fumonisin B2
Also known as fumonisin-B2, (2R)-2-[2-[(5R,6R,7S,9S,16R,18S,19S)-19-amino-6-[(3R)-3,4-dicarboxybutanoyl]oxy-16,18-dihydroxy-5,9-dimethylicosan-7-yl]oxy-2-oxoethyl]butanedioic acid, 1,2,3-Propanetricarboxylic acid, 1,1'-(1-(12-amino-9,11-dihydroxy-2-methyltridecyl)-2-(1-methylpentyl)-1,2-ethanediyl) ester
Key facts
What buyers check first
- CAS number
- 116355-84-1
- Formula
- C34H59NO14
- Molar mass
- 705.84 g/mol
- EC number
- 601-424-4
- HS code
- 292219
- Category
- Aliphatic and alicyclic building blocks
What is Fumonisin B2?
Plain description, key identifiers and synonyms
Fumonisin B2 is a fumonisin that is (2S,3S,12S,14S,15R,16R)-2-amino-12,16-dimethylicosane-3,14,15-triol in which the hydroxy groups at positions 14 and 15 have each been esterified by condensation with the 1-carboxy group of 3-carboxyglutaric acid (giving a 3-carboxyglutarate ester group with R configuration in each case). It has a role as a carcinogenic agent and an Aspergillus metabolite. It is a diol, a fumonisin, a primary amino compound and a diester.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- (2R)-2-[2-[(5R,6R,7S,9S,16R,18S,19S)-19-amino-6-[(3R)-3,4-dicarboxybutanoyl]oxy-16,18-dihydroxy-5,9-dimethylicosan-7-yl]oxy-2-oxoethyl]butanedioic acid
- CAS number
- 116355-84-1 CAS number cross-checked
- EC number
- 601-424-4
- Molecular formula
- C34H59NO14
- UNII
- UX4WHT4MKB
- InChIKey
- UXDPXZQHTDAXOZ-STOIETHLSA-N
- InChI
- InChI=1S/C34H59NO14/c1-5-6-12-21(3)32(49-31(43)18-24(34(46)47)16-29(40)41)27(48-30(42)17-23(33(44)45)15-28(38)39)14-20(2)11-9-7-8-10-13-25(36)19-26(37)22(4)35/h20-27,32,36-37H,5-19,35H2,1-4H3,(H,38,39)(H,40,41)(H,44,45)(H,46,47)/t20-,21+,22-,23+,24+,25+,26-,27-,32+/m0/s1
- Canonical SMILES
- CCCCC(C)C(OC(=O)CC(CC(=O)O)C(=O)O)C(CC(C)CCCCCCC(O)CC(O)C(C)N)OC(=O)CC(CC(=O)O)C(=O)O
- Isomeric SMILES
- CCCC[C@@H](C)[C@H]([C@H](C[C@@H](C)CCCCCC[C@H](C[C@@H]([C@H](C)N)O)O)OC(=O)C[C@@H](CC(=O)O)C(=O)O)OC(=O)C[C@@H](CC(=O)O)C(=O)O
Synonyms
- fumonisin-B2
- (2R)-2-[2-[(5R,6R,7S,9S,16R,18S,19S)-19-amino-6-[(3R)-3,4-dicarboxybutanoyl]oxy-16,18-dihydroxy-5,9-dimethylicosan-7-yl]oxy-2-oxoethyl]butanedioic acid
- 1,2,3-Propanetricarboxylic acid, 1,1'-(1-(12-amino-9,11-dihydroxy-2-methyltridecyl)-2-(1-methylpentyl)-1,2-ethanediyl) ester
- (2R)-2-(2-((5R,6R,7S,9S,16R,18S,19S)-19-amino-6-((3R)-3,4-dicarboxybutanoyl)oxy-16,18-dihydroxy-5,9-dimethylicosan-7-yl)oxy-2-oxoethyl)butanedioic acid
- 2-(2-((19-amino-6-((3,4-dicarboxybutanoyl)oxy)-16,18-dihydroxy-5,9-dimethylicosan-7-yl)oxy)-2-oxoethyl)butanedioic acid
- Fumonisin B2, Fusarium moniliforme
- (2R,2'R)-2,2'-((((5R,6R,7S,9S,16R,18S,19S)-19-Amino-16,18-dihydroxy-5,9-dimethylicosane-6,7-diyl)bis(oxy))bis(2-oxoethane-2,1-diyl))disuccinic acid
- (2R,2'R)-2,2'-{[(5R,6R,7S,9S,16R,18S,19S)-19-amino-16,18-dihydroxy-5,9-dimethylicosane-6,7-diyl]bis[oxy(2-oxoethane-2,1-diyl)]}dibutanedioic acid
- Fumonisin B2 50 microg/mL in Acetonitrile/Water
- Fumonisin B2 (>90%)
- Fumonisin B2 Solution in Methanol, 100ug/mL
- Fumonisin B2 50 |Ig/mL in Acetonitrile/Water
- 1,2,3-Propanetricarboxylic acid, 1,1'-(1-(2-amino-9,11-dihydroxy-2-methyltridecyl)-2-(1-methylpentyl)-1,2-ethanediyl) ester
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 | 705.84 g/molcalc.Computed value |
|---|---|
| Exact mass | 705.3936 Dacalc.Computed value |
| LogP (octanol/water) | 3.59calc.Computed value |
| Topological polar surface area | 268.3 ร
ยฒcalc.Computed value |
| Hydrogen bond donors | 7calc.Computed value |
| Hydrogen bond acceptors | 11calc.Computed value |
| Rotatable bonds | 29calc.Computed value |
| Heavy atoms | 49calc.Computed value |
| Rings | 0calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.82calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 9calc.Computed value |
| Lipinski rule of five | Fails (3 violations)calc.Computed value |
Calculated for screening. Confirm critical figures with the supplier.
Safety and hazards
GHS classification summary, not a safety data sheet
Hazard statements
- H300Fatal if swallowed.
- H310Fatal in contact with skin.
- H315Causes skin irritation.
- H319Causes serious eye irritation.
- H330Fatal if inhaled.
- H335May cause respiratory irritation.
- H351Suspected of causing cancer.
Precautionary statements (27)
- P203Obtain, read and follow all safety instructions before use.
- P260Do not breathe dust, fume, gas, mist, vapours or spray.
- P261Avoid breathing dust, fume, gas, mist, vapours or spray.
- P262Do not get in eyes, on skin, or on clothing.
- P264Wash skin thoroughly after handling.
- P264 + P265Wash skin thoroughly after handling. Do not touch eyes.
- P270Do not eat, drink or smoke when using this product.
- P271Use only outdoors or in a well-ventilated area.
- P280Wear protective gloves, protective clothing, eye protection and face protection.
- P284In case of inadequate ventilation wear respiratory protection.
- P301 + P316If swallowed: Get emergency medical help immediately.
- P302 + P352If on skin: Wash with plenty of water.
- P304 + P340If inhaled: Remove person to fresh air and keep comfortable for breathing.
- P305 + P351 + P338If in eyes: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
- P316Get emergency medical help immediately.
- P318If exposed or concerned, get medical advice.
- P319Get medical help if you feel unwell.
- P320Specific treatment is urgent (see supplemental first aid instructions on the label).
- P321Specific treatment (see supplemental first aid instructions on the label).
- P330Rinse mouth.
- P332 + P317If skin irritation occurs: Get medical help.
- P337 + P317If eye irritation persists: Get medical help.
- P361 + P364Take off immediately all contaminated clothing. And wash it before reuse.
- P362 + P364Take off contaminated clothing. And wash it before reuse.
- P403 + P233Store in a well-ventilated place. Keep container tightly closed.
- 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 aidFumonisin B2 suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- Price on request
- China ManufacturerUnclaimed profileFumonisin B2Grade, purity and minimum order on requestPrice on request
- China, NanjingUnclaimed profileFumonisin B2Grade, purity and minimum order on requestPrice on request
- Price on request
- United States, St. PaulUnclaimed profileFumonisin B2Grade, purity and minimum order on requestPrice on request
- China, ChangzhouUnclaimed profileFumonisin B2Grade, purity and minimum order on requestPrice on request
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Where suppliers are based
6 suppliers in 4 countries
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Fumonisin 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
Pharmacological actions
- Carcinogens, Environmental
Roles
- Aspergillus metabolite
- aetiopathogenetic role
- carcinogenic agent
- eukaryotic metabolite
- fungal metabolite
- metabolite
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 Fumonisin B2 is traded under.
Amino-alcohols, other than those containing more than one kind of oxygen function, theirโฆ
- China21.7%
- Germany17.3%
- United States15.6%
- India * partner reported11.0%
- United States9.0%
- Germany7.2%
* Partner reported figures, a lower bound.
The HS code shown for Fumonisin B2 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Fumonisin B2, based on the data on this page
What is Fumonisin B2?
What is the CAS number of Fumonisin B2?
What is the molecular formula and weight of Fumonisin B2?
What is Fumonisin B2 used for?
Is Fumonisin B2 hazardous?
What is the HS code of Fumonisin B2?
Where can I buy Fumonisin B2?
What is the price of Fumonisin B2?
Guides for buyers
Practical guides that help when you source, ship or handle Fumonisin 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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