PDND
Phytochemical Database for Neurological Disorders
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Phytochemical Name : Isopimpinellin
PCNDIDI0102
Pubchem CID : 68079
Molecular formula: C13H10O5

Molecular weight : 246.210

Canonical SMILES : COC1=C2C=COC2=C(C3=C1C=CC(=O)O3)OC

Synonymes : Isopimpinellin|482-27-9|5,8-Dimethoxypsoralen|5,8-Dimethoxypsoralene|4,9-dimethoxyfuro[3,2-g]chromen-7-one|4,9-dimethoxypsoralen|4,9-Dimethoxy-7H-furo[3,2-g]chromen-7-one|4,9-Dimethoxy-furo[3,2-g]chromen-7-one|5,8-Dimethoxy-6,7-furanocoumarin|CCRIS 4347|7H-Furo[3,2-g][1]benzopyran-7-one, 4,9-dimethoxy-|NSC 217988|NSC 401288|UNII-20GCF755G6|ISO-PIMPINELLIN|CHEBI:28853|4,9-Dimethoxy-7H-furo(3,2-G) (1)benzopyran-7-one|20GCF755G6|8-METHOXYBERGAPTEN|NSC401288|5-METHOXYXANTHOTOXIN|NSC-217988|NSC-401288|HSDB 8477|DTXSID30197457|4,9-Dimethoxy-7H-furo[3,2-g][1]benzopyran-7-one|7H-Furo(3,2-g)(1)benzopyran-7-one, 4,9-dimethoxy-|7H-Furo[3, 4,9-dimethoxy-|7H-Furo(3,2-g)(1)benzopyran-7-one, 4,9-dimethoxy- (8CI)|MFCD00017407|4,9-dimethoxy-7H-furo(3,2-g)chromen-7-one|4,9-Dimethoxy-7H-furo(3,2-g)(1)benzopyran-7-one|Dimethylpsoralen|Spectrum_000624|SpecPlus_000154|5, 8-Dimethoxypsoralene|Spectrum2_000308|Spectrum3_001232|Spectrum4_001442|Spectrum5_000023|Oprea1_132007|Oprea1_593894|BSPBio_002704|KBioGR_001923|KBioSS_001104|SPECTRUM300012|MLS000876836|DivK1c_006250|SCHEMBL498907|SPBio_000276|CHEMBL140796|MEGxp0_000706|ACon1_002361|DFMAXQKDIGCMTL-UHFFFAOYSA-|KBio1_001194|KBio2_001104|KBio2_003672|KBio2_006240|KBio3_002204|DTXCID40119948|GLXC-14378|HMS2270M12|Isopimpinellin, analytical standard|HY-N0769|BDBM50361386|CCG-38585|NSC217988|s9291|STK368476|AKOS000278000|Isopimpinellin (4,9-Dimethoxypsoralen)|SDCCGMLS-0066520.P001|NCGC00095569-01|NCGC00095569-02|NCGC00095569-03|AC-34959|BS-16832|LS-70709|NCI60_003765|SMR000440593|4,9-Dimethoxy-7-oxofuro[3,2-g]chromene|4,9-Dimethoxyfuro[3,2-g]benzopyran-7-one|CS-0009794|FT-0603412|I0861|5,9-dimethoxy-2H-furo[3,2-g]chromen-2-one|C02162|4,9-Dimethoxy-7H-furo[3,2-g]chromen-7-one #|Isopimpinellin - Angelica archangelica (angelica)|SR-01000778471|Q-100529|Q6086206|SR-01000778471-2|BRD-K72253829-001-02-8|BRD-K72253829-001-03-6|BRD-K72253829-001-07-7|4,9-Dimethoxy-7H-furo[3,2-g][1]benzopyran-7-one, 9CI|5,8-Dimethoxypsoralen; 4,9-dimethoxyfuro[3,2-g]chromen-7-one

Structure
3D structure 2D structure
68079
Predicted properties (NCBI Pubchem)

Physicochemical Properties