phocaecholic acid isomer

phocaecholic acid isomer
  • Name: (2S,4R)-4-((3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-hydroxypentanoic acid
  • Catalog No.: CPD108080
  • CAS No.: 105880-09-9
  • Molecular Weight: 408.57
  • Chemical Formula: C24 H40 O5
  • For scientific research only, not for patients.

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    Chemical Name:

    (2S,4R)-4-((3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethylhexadecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-hydroxypentanoic acid

    SMILES Code: 

    [H][C@@]12CC[C@H]([C@H](C)C[C@H](O)C(O)=O)[C@@]1(C)CC[C@@]1([H])[C@@]2([H])[C@H](O)C[C@]2([H])C[C@H](O)CC[C@@]21C

    InChi Code:

    InChI=1S/C24H40O5/c1-13(10-20(27)22(28)29)16-4-5-17-21-18(7-9-24(16,17)3)23(2)8-6-15(25)11-14(23)12-19(21)26/h13-21,25-27H,4-12H2,1-3H3,(H,28,29)/t13-,14+,15-,16-,17+,18+,19-,20+,21+,23+,24-/m1/s1

    InChi Key:

    SLDVWYDDPPFGHK-CIEAULFFSA-N

    Keyword:

    105880-09-9;CAS:105880-09-9;CAS:105880-09-9;phocaecholic acid isomer

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