Demannose

CAS 3458-28-4  ·  C6H12O6  ·  MW 180.16 g/mol

Loading molecule...
3D model Demannose, CAS 3458-28-4, molecular formula C6H12O6, molar mass 180.16 g/mol
About Demannose

Demannose is a chemical compound registered under number CAS 3458-28-4, with the molecular formula C6H12O6, and a molar mass of 180.16 g/mol.

The molecule contains 24 atoms connected by 23 chemical bonds. The full systematic IUPAC name of this compound is (2S,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = -2.9 (negative value, a hydrophilic compound), polar surface area PSA = 118 Ų, 5 donors and 6 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC6H12O6
Masa molowa180.16 g/mol
IUPAC(2S,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal
SMILESC([C@H]([C@H]([C@@H]([C@@H](C=O)O)O)O)O)O
InChIKeyGZCGUPFRVQAUEE-KVTDHHQDSA-N
logP (XLogP3)-2.9
PSA118 Ų
HBD / HBA5 / 6
PubChem CIDCID 161658 ↗
Scientific literature

Related literature

20 articles · 3 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (20 articles)

1945: 1 articles19451946: 1 articles1991: 1 articles2000: 1 articles2009: 1 articles2012: 2 articles20122016: 2 articles2018: 2 articles2021: 1 articles2022: 6 articles2023: 1 articles2023

Bar height = number of articles per year. Hover dla szczegółów.

(2018) · Encyclopedia of Signaling Molecules
$ PaywallDOI ↗
(2021) · Encyclopedia of Evolutionary Psychological Science
$ PaywallDOI ↗
(2012) · Encyclopedia of the Sciences of Learning
$ PaywallDOI ↗

Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
(2S,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanal · Demannose · PHA4727WTP · CERC-802 · GlyTouCan:G95531HX · RefChem:1083138 · G95531HX · 3458-28-4 · DL-Mannose · aldehydo-D-mannose · 31103-86-3 · aldehydo-D-manno-hexose · Mannose, D- · 30142-85-9 · MFCD00799233
Data sources
Related molecules
—
License & Provenance

MolGod 3D molecular model
Demannose — CAS 3458-28-4

License: CC BY-SA 4.0 (source rights NIEUSTALONE — not yet granted for this model)

MolGod License & Provenance Record:
Demannose (CAS 3458-28-4) — License & Provenance

Source:
Demannose (CAS 3458-28-4) — MolGod molecule record

Source data: PubChem CID 161658

STL: Download 3D model (483 KB)

SHA-256: e078d30c6897c58e25273ff214aab6f3fa4a6d00460f4a19f69bea95176d8e55

Wikimedia Commons: not published yet

Source data: PubChem CID 161658

This licence applies to the MolGod-created STL mesh, not automatically to third-party source material.