Basic information
- CAS
134381-30-9- Standard SMILES
CC(O)C(O)C(C)C(=O)NC(C)(CO)C(=O)O- InChIKey
XXCXSSMNJUZBQI-UHFFFAOYSA-N- Molecular formula
- C10H19NO6
- Average molar mass
- 249.26 g/mol
- Monoisotopic mass
- 249.12123733
Overview
N-(3,5-Dideoxy-3-methyl-D-xylonoyl)-2-methyl-L-serine has been reported in Streptomyces filamentosus with data available.
Names & identifiers
- Preferred name
- (2S)N-((2R,3S,4R)-2,4-Dihydroxy-3-methyl-pentanoyl)-2-methylserine
- IUPAC
- 2-[(3,4-dihydroxy-2-methylpentanoyl)amino]-3-hydroxy-2-methylpropanoic acid
- English name
- conagenin
- Molecular formula
- C10H19NO6
- Molecular weight
- 249.26
Names & synonyms
ConagenineSCHEMBL30375048(2S)N-((2R,3S,4R)-2,4-Dihydroxy-3-methyl-pentanoyl)-2-methylserineconageninL-Serine, N-(3,5-dideoxy-3-methyl-D-xylonoyl)-2-methyl-N-(3-Methyl-3,5-dideoxy-D-xylos-1-yl)-2-methyl-L-serine
Database identifiers
- CAS
134381-30-9- PubChem CID
- 3035656
Properties
Computed structural properties
- XLogP
- -1.7
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 295
Chemistry & industry
Applications
DescriptionConagenin is a low molecular weight immunomodulator produced by Streptomyces roseosporus.
UsesConagenin is an immunomodulator. Conagenin shows antitumor effects by activation of T cells and increasing antitumor effector cells[1].
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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