(S)-Propane-1,2-diol (BioCAD00000001016)
Metabolite Card
Formula: C3H8O2 (76.0524)
SMILES: C[C@H](O)CO
Synonyms [en]
(S)-Propylene glycol; (S)-Propane-1,2-diol; (S)-1,2-Propanediol; (2S)-propane-1,2-diol; (S)-2-HYDROXYPROPANOL; (S)-(+)-Propylene Glycol
Last reviewed on 2024-06-28.
Cite this Page
(S)-Propane-1,2-diol. 数据之源,洞见之始. SMRUCC genomics institute, a synthetic life researcher from China.
https://biocad_registry.innovation.ac.cn/s/(-)-arctiin
(retrieved
2026-01-03) (CAD Registry RN: BioCAD00000001016). Licensed
under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).
Note
(S)-Propane-1,2-diol, also known as (S)-1,2-propanediol or (S)-propylene glycol, belongs to the class of organic compounds known as 1,2-diols. These are polyols containing an alcohol group at two adjacent positions. (S)-Propane-1,2-diol is an extremely weak basic (essentially neutral) compound (based on its pKa). (S)-Propane-1,2-diol has been detected, but not quantified in, several different foods, such as common buckwheats, mustard spinach, sugar apples, black crowberries, and bayberries. This could make (S)-propane-1,2-diol a potential biomarker for the consumption of these foods. (S)-Propane-1,2-diol is a clear, colourless, viscous organic solvent and diluent used in pharmaceutical preparations.
DBLinks
- CAS Registry Number: 4254-15-3
- PubChem CID: 439846
- ChEBI: 29002
- HMDB: HMDB0006213
- LipidMaps:
- KEGG: C02917
- BioCyc: PROPANE-1-2-DIOL
- NCBI MeSH:
- Wikipedia: Propylene_glycol
Other DBLinks
- CAS Registry Number: 4254-15-3
- PubChem: 439846
- ChEBI: ChEBI:29002
- HMDB: HMDB0006213
- KEGG: C02917
- BioCyc: PROPANE-1-2-DIOL
- Wikipedia: Propylene_glycol
- DrugBank: DB04349
- Coconut NaturalProduct: CNP0522839.1
Class / Ontology
- WishartLab ClassyFire: [Alcohols and polyols] Alcohols and polyols
- ChEBI: [CHEBI:29002] (S)-propane-1,2-diol
- Coconut NaturalProduct: [Fatty alcohols] Fatty alcohols
| ID | EC Number | Name |
|---|---|---|
| KEGG:R02258 | 1.1.1.77 | (S)-propane-1,2-diol:NAD+ oxidoreductase |
| BioCyc:LACTALDREDUCT-RXN | 1.1.1.77 | PROPANE-1-2-DIOL + NAD<=>LACTALD + NADH + PROTON |
| BioCyc:RXN-8632 | PROPANE-1-2-DIOL + NAD<=>ACETOL + NADH + PROTON | |
| BioCyc:RXN-15744 | 1.1.1.55 | LACTALD + NADPH + PROTON --> PROPANE-1-2-DIOL + NADP |
| Rhea:RHEA:15934 | 1.1.1.77 | (S)-propane-1,2-diol + NAD+ => (S)-lactaldehyde + NADH + H+ |
| Rhea:RHEA:15935 | 1.1.1.77 | (S)-lactaldehyde + NADH + H+ => (S)-propane-1,2-diol + NAD+ |
| Rhea:RHEA:15936 | 1.1.1.77 | (S)-propane-1,2-diol + NAD+ <=> (S)-lactaldehyde + NADH + H+ |
| Rhea:RHEA:28668 | hydroxyacetone + NADH + H+ => (S)-propane-1,2-diol + NAD+ | |
| Rhea:RHEA:28669 | (S)-propane-1,2-diol + NAD+ => hydroxyacetone + NADH + H+ | |
| Rhea:RHEA:28670 | hydroxyacetone + NADH + H+ <=> (S)-propane-1,2-diol + NAD+ | |
| BioCyc:PROPANEDIOL-DEHYDRATASE-RXN | 4.2.1.28 | PROPANE-1-2-DIOL --> CPD-665 + WATER |
| BioCyc:RXN-22516 | 1.1.1.21 | ACETOL + NADPH + PROTON --> PROPANE-1-2-DIOL + NADP |
Taxonomy Source
- Chaenomeles sinensis [ncbi taxid: ]
- Escherichia coli [ncbi taxid: 562]
- Homo sapiens [ncbi taxid: 9606]
Pathway Synthetic
| pathway id | name |
|---|---|
| BioCyc:HUMAN_PWY-5453 | methylglyoxal degradation III |
| BioCyc:META_PWY-7013 | (S)-propane-1,2-diol degradation |
| BioCyc:META_FUC-RHAMCAT-PWY | superpathway of fucose and rhamnose degradation |
| BioCyc:ECO_PWY0-1315 | L-lactaldehyde degradation (anaerobic) |
| BioCyc:ECO_PWY-5453 | methylglyoxal degradation III |
| BioCyc:ECOO157_FUC-RHAMCAT-PWY | superpathway of fucose and rhamnose degradation |
| BioCyc:ECOL199310_PWY-5453 | methylglyoxal degradation III |
| BioCyc:ECOL199310_FUC-RHAMCAT-PWY | superpathway of fucose and rhamnose degradation |
| BioCyc:ECOL199310_PWY0-1315 | L-lactaldehyde degradation (anaerobic) |
| BioCyc:ECOL316407_FUC-RHAMCAT-PWY | superpathway of fucose and rhamnose degradation |
| BioCyc:ECOL413997_PWY0-1315 | L-lactaldehyde degradation (anaerobic) |
| BioCyc:ECOL413997_PWY-5453 | methylglyoxal degradation III |
| BioCyc:CLOSSAC_PWY0-1315 | L-lactaldehyde degradation (anaerobic) |
| BioCyc:CLOSSAC_FUC-RHAMCAT-PWY | superpathway of fucose and rhamnose degradation |
| BioCyc:COLLINSAERO_PWY0-1315 | L-lactaldehyde degradation (anaerobic) |
| BioCyc:ECO_METHGLYUT-PWY | superpathway of methylglyoxal degradation |
| BioCyc:SHIGELLA_PWY0-1315 | L-lactaldehyde degradation (anaerobic) |
| BioCyc:SHIGELLA_FUC-RHAMCAT-PWY | superpathway of fucose and rhamnose degradation |
| BioCyc:ECOO157_PWY-5453 | methylglyoxal degradation III |
| BioCyc:SCO_PWY0-1315 | L-lactaldehyde degradation (anaerobic) |