Osthol

  • Định danh

    Số CAS
    484-12-8

    Công thức phân tử
    C15H16O3

    SMILES
    CC(=CCC1=C(C=CC2=C1OC(=O)C=C2)OC)C

    Chỉ số lưu (RI)

    • DB5: 2138.0
    • Carbowax: 2923.0

  • Hồ sơ mùi hương

    thảo mộc 56.67%
    cay 48.99%
    ngọt 37.29%
    gỗ 34.0%
    phenol 33.67%
    thuốc lá 29.66%
    bạc hà 29.42%
    ấm áp 28.61%
    trái cây 28.55%
    khô 28.55%

    Scent© AI

  • Thuộc tính

    XLogP3-AA
    3.8 Tan tốt trong BB, DEP, IPM

    Khối lượng phân tử
    244.28 g/mol

    Nhiệt độ tan chảy

    • 83-84 °C

    Độ tan

    • In water, 12.0 mg/L at 30 °C
    • Practically insoluble in water
    • Soluble in aqueous alkalies, alcohol, chloroform, acetone, boiling petroleum ether

  • Các tên gọi

    • Osthole
    • Osthol
    • 484-12-8
    • Ostole
    • Ostol
    • 7-methoxy-8-(3-methylbut-2-en-1-yl)-2H-chromen-2-one
    • 2H-1-Benzopyran-2-one, 7-methoxy-8-(3-methyl-2-butenyl)-
    • 7-Methoxy-8-isopentenylcoumarin
    • 7-methoxy-8-(3-methylbut-2-enyl)chromen-2-one
    • 8-(3-Methyl-2-butenyl)herniarin
    • 7-methoxy-8-(3-methyl-2-buten-1-yl)-2H-chromen-2-one
    • 7-methoxy-8-(3-methyl-2-butenyl)coumarin
    • NSC 31868
    • UNII-XH1TI1759C
    • Coumarin, 7-methoxy-8-(3-methyl-2-butenyl)-
    • XH1TI1759C
    • 7-METHOXY-8-(3-METHYL-2-BUTENYL)-COUMARIN
    • MFCD00076049
    • NSC-31868
    • CHEMBL52229
    • CHEBI:69832
    • HSDB 8479
    • NSC31868
    • 7-methoxy-8-(3-methyl-2-butenyl)-2h-1-benzopyran-2-one
    • 7-METHOXY-8-(3-METHYLBUT-2-ENYL)-2-CHROMENONE
    • SMR000156202
    • Osthole (Osthol)
    • A0O
    • 7-Methoxy-8-(3-methyl-but-2-enyl)-chromen-2-one
    • Osthole (Standard)
    • Spectrum_001542
    • SpecPlus_000946
    • OSTHOLE [MI]
    • 7-methoxy-8-(3-methylpent-2-enyl)coumarin
    • Spectrum2_000723
    • Spectrum3_001645
    • Spectrum4_001687
    • Spectrum5_000334
    • Osthole, analytical standard
    • Oprea1_642606
    • Oprea1_873803
    • SCHEMBL50436
    • BSPBio_003369
    • KBioGR_001954
    • KBioSS_002022
    • MLS000574904
    • MLS001048988
    • MLS006011425
    • DivK1c_007042
    • SPECTRUM1504165
    • SPBio_000646
    • MEGxp0_000155
    • ACon1_002155
    • GTPL10302
    • HY-N0054R
    • KBio1_001986
    • KBio2_002022
    • KBio2_004590
    • KBio2_007158
    • KBio3_002589
    • DTXSID20197507
    • HMS2267O21
    • HMS3656A07
    • BCP10832
    • HY-N0054
    • BBL013019
    • BDBM50240512
    • CCG-40172
    • s2337
    • STK396321
    • AKOS000277663
    • AC-8041
    • DS-0881
    • FO09975
    • SDCCGMLS-0066780.P001
    • NCGC00095694-01
    • NCGC00095694-02
    • NCGC00095694-03
    • NCGC00095694-05
    • NCGC00095694-06
    • WLN: T66 BOVJ IO1 J2UY1&1
    • NS00031794
    • O0426
    • SW219438-1
    • C09280
    • AM-721/20651007
    • Osthole, primary pharmaceutical reference standard
    • SR-01000721624
    • Q4338679
    • SR-01000721624-4
    • BRD-K78294846-001-03-3
    • BRD-K78294846-001-12-4
    • 7-Methoxy-8-(3-methyl-2-butenyl)-2H-chromen-2-one #
    • Osthole, European Pharmacopoeia (EP) Reference Standard
    • 7-Methoxy-8-(3-methyl-2-buten-1-yl)-2H-1-benzopyran-2-one
    • 7-Methoxy-8-(3-methyl-2-butenyl)coumarin;7-Methoxy-8-isopentenylcoumarin;Osthol
    • 1440642-68-1
    • InChI=1/C15H16O3/c1-10(2)4-7-12-13(17-3)8-5-11-6-9-14(16)18-15(11)12/h4-6,8-9H,7H2,1-3H
1 4

Thực vật

Tên CAS Thực vật Tỷ lệ
Orange, bitter (Spain) 1 72968-50-4 Citrus aurantium L., ssp. amara Engl., fam. Rutaceae 0.2%
Orange, bitter (Spain) 2 72968-50-4 Citrus aurantium L., ssp. amara Engl., fam. Rutaceae 0.1%
Angelica root (Finland) 4 8015-64-3 Angelica archangelica L. var. archangelica, fam. Apiaceae (Umbelliferae) 6.75%
Angelica root (Finland) 3 8015-64-3 Angelica archangelica L. var. sativa, fam. Apiaceae (Umbelliferae) 8.45%
Angelica root (Brazil) 1a hydrodistilled 8015-64-3 Angelica archangelica L., fam. Apiaceae (Umbelliferae) 1.0%
Pummelo (Shaddock) (India) peel 84696-38-8 Citrus maxima (J. Burman) Merrill. (C. grandis (L.) Osbeck), fam. Rutaceae 0.01%
Zosima absinthifolia fruit Zosima absinthifolia (Vent.) Link, fam. Apiaceae (Umbelliferae) 1.5%
Angelica root (Brazil) 1b CO2 extract 8015-64-3 Angelica archangelica L., fam. Apiaceae (Umbelliferae) 4.3%