INT777; 6-EMCA; S-EMCA; ​HY-15677

INT777; 6-EMCA; S-EMCA; ​HY-15677
  • Name: (2S,4R)-4-((3R,5S,6R,7R,8R,9S,10S,12S,13R,14S,17R)-6-ethyl-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylpentanoic acid
  • Catalog No.: CPD1824
  • CAS No.: 1199796-29-6
  • Molecular Weight: 450.65
  • Chemical Formula: C27 H46 O5
  • For scientific research only, not for patients.

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    Chemical Name:

    (2S,4R)-4-((3R,5S,6R,7R,8R,9S,10S,12S,13R,14S,17R)-6-ethyl-3,7,12-trihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methylpentanoic acid

    SMILES Code: 

    O[C@@H]1CC[C@@]2(C)[C@@]([C@@H](CC)[C@@H](O)[C@]3([H])[C@]2([H])C[C@H](O)[C@@]4(C)[C@@]3([H])CC[C@]4([H])[C@H](C)C[C@H](C)C(O)=O)([H])C1

    InChi Code:

    InChi Code InChI=1S/C27H46O5/c1-6-17-20-12-16(28)9-10-26(20,4)21-13-22(29)27(5)18(14(2)11-15(3)25(31)32)7-8-19(27)23(21)24(17)30/h14-24,28-30H,6-13H2,1-5H3,(H,31,32)/t14-,15+,16-,17-,18-,19+,20+,21+,22+,23+,24-,26+,27-/m1/s1

    InChi Key:

    NPBCMXATLRCCLF-IRRLEISYSA-N

    Keyword:

    1199796-29-6;CAS:1199796-29-6;CAS:1199796-29-6;INT777;6-EMCA; S-EMCA;​HY-15677

    Solubility: Soluble in DMSO

    Storage: Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).

    Description: 

    INT-777 is an effective TGR5 agonist.

    Target: TGR5




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