Basic information
- CAS
596093-98-0- Standard SMILES
Cc1c(C)[n+](Cc2ccccc2)cn1Cc1ccccc1.[Cl-]- InChIKey
ZATWGHMQWRXUNZ-UHFFFAOYSA-M- Molecular formula
- C19H21ClN2
- Average molar mass
- 312.8 g/mol
- Monoisotopic mass
- 312.1393264
Overview
Lepidiline A is a flavonolignan.
Names & identifiers
- Preferred name
- Lepidiline A
- IUPAC
- 1,3-dibenzyl-4,5-dimethylimidazol-1-ium chloride
- English name
- Lepidiline A
- Molecular formula
- C19H21ClN2
- Molecular weight
- 312.84
Names & synonyms
LEPIDILINE A596093-98-0Macaline A29S9F3SV9QUNII-29S9F3SV9Q1,3-dibenzyl-4,5-dimethylimidazolium chloride1H-Imidazolium, 4,5-dimethyl-1,3-bis(phenylmethyl)-, chloride (1:1)RefChem:418751,3-dibenzyl-4,5-dimethyl-1h-imidazol-3-ium chloride1,3-dibenzyl-4,5-dimethylimidazol-1-ium;chlorideLepidiline A?NSC721146
Show more names
1,3-Dibenzyl-4,5-dimethyl-1H-imidazol-3-ium chloride , Lepidiline A
CHEMBL461065orb1702064orb2901449SCHEMBL4081734SCHEMBL4081737CHEBI:232527ZATWGHMQWRXUNZ-UHFFFAOYSA-MAKOS040747037
Database identifiers
- CAS
596093-98-0- PubChem CID
- 404702
- ChEMBL
CHEMBL461065- ChEBI
CHEBI:232527- UNII
- 29S9F3SV9Q
Properties
Computed structural properties
- Topological polar surface area
- 8.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- Melting point
- 128 · 128-130 °C(Solv: acetone (67-64-1))
- storage temp.
- -20 °C · Store at -20°C
- form
- Solid
- color
- White to off-white
- Major Application
- food and beveragespharmaceutical
- FDA UNII
- 29 S9F3SV9Q · 29S9F3SV9Q
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302,H315,H319
- Precautionary statements
- 264 · P264-P280-P301+P312-P302+P352-P305+P351+P338-P332+P313
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302,H315,H319
- Precautionary statements
- P264-P280-P301+P312-P302+P352-P305+P351+P338-P332+P313
Chemistry & industry
Applications
UsesLepidiline A exhibits cytotoxic activity against HL-60 cells with an IC50 value of 32.3 μM. Lepidiline A targets HSD17B1 activity, increases the bioconversion efficiency of sex hormones (including the conversion of estrogen into 17β-estradiol and 4-androsten-3,7-dione into testosterone), thereby improving the reproductive capacity of fruit flies.[1][2].
Suppliers14 total
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
江苏艾康生物医药研发有限公司025-5885952 15955137747 · [email protected]
湖北魏氏化学试剂股份有限公司17771898297 13125137661 · [email protected]
天津普西唐生物医药科技有限公司010-60605840 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海超岚化工科技中心（原宁波市超明生物科技有限公司）13301662590 · [email protected]
安阳鸿蒙新材料有限公司19588588067 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
天津凯利奇生物科技有限公司15076683720 · [email protected]
ATK CHEMICAL COMPANY LIMITED+undefined-21-51877795 · [email protected]
安庆研至医药科技有限公司18055651951 · [email protected]
TargetMol中国（陶术生物）4008200310 15002144251 · [email protected]
上海一飞生物科技有限公司021-65675885 18964387627 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
Related reactions
1 records
Compound notes
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