Aceglatone
Also known as Glucaron, Aceglatona, Aceglatonum
Key facts
What buyers check first
- CAS number
- 642-83-1
- Formula
- C10H10O8
- Molar mass
- 258.18 g/mol
- HS code
- 293220
- Category
- Heterocyclic building blocks
What is Aceglatone?
Plain description, key identifiers and synonyms
Aceglatone is an organic molecular entity.
Aceglatone is an antineoplastic drug available in Japan.
Identifiers
Registry numbers, names and line notations, tap to copy
- IUPAC name
- [(3R,3aS,6S,6aS)-6-acetyloxy-2,5-dioxo-3,3a,6,6a-tetrahydrofuro[3,2-b]furan-3-yl] acetate
- CAS number
- 642-83-1 CAS number cross-checked
- Molecular formula
- C10H10O8
- UNII
- 347Q3OOJ13
- InChIKey
- ZOZKYEHVNDEUCO-DKXJUACHSA-N
- InChI
- InChI=1S/C10H10O8/c1-3(11)15-7-5-6(18-9(7)13)8(10(14)17-5)16-4(2)12/h5-8H,1-2H3/t5-,6-,7-,8+/m0/s1
- Canonical SMILES
- CC(=O)OC1C(=O)OC2C(OC(C)=O)C(=O)OC12
- Isomeric SMILES
- CC(=O)O[C@@H]1[C@@H]2[C@@H]([C@@H](C(=O)O2)OC(=O)C)OC1=O
Synonyms
- Glucaron
- Aceglatona
- Aceglatonum
- D-Glucaric acid 1,4:6,3-dilactone diacetate
- 2,5-Di-O-acetyl-D-glucaro-1,4:6,3-dilactone
- 2,5-Di-O-acetyl-D-glucosaccharo-1,4:6,3-dilactone
- D-Glucaric acid di-gamma-lactone diacetate
- 2,5-di-O-acetyl glucaro-(1,4)-(6-3)-dilactone
- diacetyl glucaro-(1,4)-(6-3)-dilactone
- GlyTouCan:G56543CB
- [(3R,3aS,6S,6aS)-6-acetyloxy-2,5-dioxo-3,3a,6,6a-tetrahydrofuro[3,2-b]furan-3-yl] acetate
- (3R,3aS,6S,6aS)-2,5-dioxohexahydrofuro[3,2-b]furan-3,6-diyl diacetate
- Aceglaton
- Glucaron (TN)
- Aceglatone (JAN/INN)
- Glucaric acid, 1,4:6,3-dilactone, diacetate, D-
- [(3R,3aR,6S,6aR)-6-acetyloxy-2,5-dioxo-3,3a,6,6a-tetrahydrofuro[3,2-b]furan-3-yl] acetate
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 | 258.18 g/molcalc.Computed value |
|---|---|
| Exact mass | 258.0376 Dacalc.Computed value |
| LogP (octanol/water) | -1.3calc.Computed value |
| Topological polar surface area | 105.2 Ųcalc.Computed value |
| Hydrogen bond donors | 0calc.Computed value |
| Hydrogen bond acceptors | 8calc.Computed value |
| Rotatable bonds | 2calc.Computed value |
| Heavy atoms | 18calc.Computed value |
| Rings | 2calc.Computed value |
| Aromatic rings | 0calc.Computed value |
| Fraction sp3 carbons | 0.6calc.Computed value |
| Formal charge | 0calc.Computed value |
| Stereocentres | 4calc.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
O=C1CC2OC(=O)CC2O1
2 rings, 10 atoms, the Tetrahydrofuro[3,2-b]furan-2,5-dione ring system.
4 other chemicals share this scaffoldSafety and hazards
GHS classification summary, not a safety data sheet
No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.
GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.
Aceglatone suppliers
Sponsored listings first, then the documented ranking: membership, verification, replies, completeness, freshness and ratings
- JapanUnclaimed profileAceglatoneGrade, purity and minimum order on requestPrice on request
- South Korea, Sa-DongUnclaimed profileAceglatoneGrade, 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
2 suppliers in 2 countries
Send one request to many suppliers
Choose up to 10 suppliers or let us match your request. Compare quotes side by side, free.
Aceglatone price
Indicative price range per kg from live supplier offers
Suppliers quote this chemical on request. Send one free request and compare quotes side by side.
Uses and applications
What the substance is used for, by industry and function
Industries and functions
Pharmacology
Aceglatone is a derivative of D-glucaro-1, 4-lactone with chemopreventive and anti-tumor activities. One of the key processes in which human body eliminates toxic chemicals as well as hormones (such as estrogen) is by glucuronidation. When beta-glucuronidase deconjugates these glucuronides, it prolongs the stay of the hormone or toxic chemical in the body. Elevated beta-glucuronidase activity has been implicated to be associated with an increased risk for hormone-dependent cancers like breast, prostate, and colon cancers. Thereby, aceglatone may suppress the developments of hormone-dependent cancers mediated through beta-glucuronidase inhibition.
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 Aceglatone is traded under.
Lactones
- United States14.2%
- India * partner reported13.5%
- Brazil8.5%
* Partner reported figures, a lower bound.
The HS code shown for Aceglatone is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.
Frequently asked questions
Quick answers about Aceglatone, based on the data on this page
What is Aceglatone?
What is the CAS number of Aceglatone?
What is the molecular formula and weight of Aceglatone?
What is Aceglatone used for?
Is Aceglatone hazardous?
What is the HS code of Aceglatone?
Where can I buy Aceglatone?
What is the price of Aceglatone?
Guides for buyers
Practical guides that help when you source, ship or handle Aceglatone
- 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
- Article, SourcingHow to write an RFQ that gets fast and accurate quotesWhat suppliers need to quote quickly and comparably: exact product identity, quantity and packing, delivery terms, documents, samples and payment, with a ready to use template.Read
- Guide, Trade and logisticsHS codes for chemicals and why they matterHow the Harmonized System classifies chemicals, the chapters that matter, the rules for chemically defined compounds and mixtures, and practical steps to find the right code.Read
Get quotes for Aceglatone
Embed this structure on your websiteShow code
Paste this code into your page to show the 2D structure of Aceglatone with a 3D view, its CAS number where known and a link back to this page. Free to use with the link kept.
<iframe src="https://www.compoundlist.com/embed/structure/aceglatone-642-83-1" title="Aceglatone structure on CompoundList" width="360" height="420" style="border:1px solid #E7E2DA;border-radius:12px;max-width:100%" loading="lazy" referrerpolicy="strict-origin-when-cross-origin"></iframe>Explore more in Heterocyclic building blocks or HS code 293220