Basic information
- CAS
520-42-3- Standard SMILES
COc1cc(O)c(C(=O)CCc2ccc(O)cc2)c(O)c1- InChIKey
UPXIBKPHJYQSGP-UHFFFAOYSA-N- Molecular formula
- C16H16O5
- Average molar mass
- 288.29 g/mol
- Monoisotopic mass
- 288.09977361
Overview
Asebogenin is a member of the class of dihydrochalcones that is the 4'-methyl ether derivative of phloretin. It has a role as a plant metabolite. It is functionally related to a phloretin.
Names & identifiers
- Preferred name
- Asebogenin
- IUPAC
- 1-(2,6-dihydroxy-4-methoxyphenyl)-3-(4-hydroxyphenyl)propan-1-one
- English name
- asebogenin
- Molecular formula
- C16H16O5
- Molecular weight
- 288.3
Names & synonyms
Asebogenin520-42-31-(2,6-dihydroxy-4-methoxyphenyl)-3-(4-hydroxyphenyl)propan-1-onePhloretin 4'-methyl etherCHEBI:2871DTXSID60331781RefChem:114499DTXCID102828752',6',4-Trihydroxy-4'-methoxydihydrochalcone4'-O-MethylphloretinDihydroisosakuranetinCHEMBL253257
Show more names
Asebogenin, 10 mM in DMSO1-Propanone, 1-(2,6-dihydroxy-4-methoxyphenyl)-3-(4-hydroxyphenyl)-
orb1683115SCHEMBL4740064HY-N73141-(2,6-Dihydroxy-4-methoxyphenyl)-3-(4-hydroxyphenyl)-1-propanoneLMPK12120545TN3460AKOS040761380XD161717
Database identifiers
- CAS
520-42-3- PubChem CID
- 442255
- DTXSID
DTXSID60331781- ChEMBL
CHEMBL253257- ChEBI
CHEBI:2871- Nikkaji
- J367.549A
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 326
Experimental & physicochemical properties
LipidsPolyketides [PK] -> Flavonoids [PK12] -> Chalcones and dihydrochalcones [PK1212]
Physicochemical properties
- Melting point
- 168 ℃ · 168℃
- Boiling point
- 550.9 · 550.9±50.0 °C(Predicted)
- Density
- 1.325 · 1.325±0.06 g/cm3(Predicted)
- pka
- 7 · 7.00±0.40(Predicted)
Chemistry & industry
Applications
UsesAsebogenin has antimalarial activity in vitro[1]. Asebogenin can inhibit the phosphorylation of Syk, thereby effectively suppressing platelet activation and the formation of neutrophil extracellular traps[2].
Suppliers32 total
湖北万得化工有限公司15377098680 15377098680 · [email protected]
Shaanxi Haibo Biotechnology Co., Ltd+86-18629295024 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
武汉众志诚生物技术有限公司13628624121 13628604890 · [email protected]
成都普睿法药物研发有限公司82633860 18982077548 · [email protected]
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
成都普思生物科技股份有限公司028-85370565-229 18080489829 · [email protected]
TransMIT GmbH PlantMetaChem+49-172-1024293 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]
云南西力生物技术股份有限公司0871-65217109 · [email protected]
四川省维克奇生物科技有限公司028-81700200 18116577057 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
成都仪睿生物科技有限公司18224028459 18224028459 · [email protected]
成都仪捷睿生物科技有限公司18224018291 18224018291 · [email protected]
ALB Technology Limited702-983-3769 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
EMMX Biotechnology LLC888-539-0666 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
上海源叶生物科技有限公司13636370518 · [email protected]
爱必信（上海）生物科技有限公司13761418683 · [email protected]
南京道斯夫生物科技有限公司16651696448 · [email protected]
成都普瑞法科技开发有限公司+86-28-82633860; +86-18080483897 · [email protected]
上海博湖生物科技有限公司021-57763112 13585886131 · [email protected]
ANHUI WITOP BIOTECH CO., LTD+8618071025641 · [email protected]
雷丁科技0510-85629785 18013409632 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
上海莫奇生物科技有限公司13341702378 · [email protected]
四川百奥克睿生物科技有限公司28-86-28-8543-3893 13260669172 · [email protected]
BOC Sciences+1-631-485-4226 · [email protected]
北京谱析科技有限公司400-808-7372 13161114455 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354 · [email protected]
上海阿摩尔生物科技有限公司13370042665 18916960931 · [email protected]
Additional notes
DefinitionChEBI: A member of the class of dihydrochalcones that is the 4'-methyl ether derivative of phloretin.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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