Molecule

(Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3S)-3-hydroxy-5-phenylpent-1-enyl]cyclopentyl]-N-ethylhept-5-enamide

Chemical Information

Molecular Image
InChI InChI=1S/C25H37NO4/c1-2-26-25(30)13-9-4-3-8-12-21-22(24(29)18-23(21)28)17-16-20(27)15-14-19-10-6-5-7-11-19/h3,5-8,10-11,16-17,20-24,27-29H,2,4,9,12-15,18H2,1H3,(H,26,30)/b8-3-,17-16+/t20-,21+,22+,23-,24+/m0/s1
SMILES CCN([H])C(CCC/C=C\C[C@@H]1[C@@H](/C=C/[C@@H](O)CCC2=CC=CC=C2)[C@H](O)C[C@@H]1O)=O
InChI Key AQOKCDNYWBIDND-FTOWTWDKSA-N
Exact Mass 415.272 g/mol

Metadata Information

Field Value
NFDI4Chem Molecule ID nfdi4chem-mol28792
Source
Alternate Name
    Field Value
    No additional information available for this Dataset.
    Data-Source Molecule ID Data-Source
    DB00905 drugbank
    CHEBI:51230 chebi
    15M rcsb_pdb
    CHEMBL1200963 chembl
    24425 surechembl
    5311027 pubchem
    QXS94885MZ fdasrs
    15M pdbe
    PD009654 probes_and_drugs
    13626 brenda
    153380 brenda
    154363 brenda
    27704 brenda
    HMDB0015041 hmdb
    DTXSID30895042 comptox
    NCT00273455 clinicaltrials
    NCT00300443 clinicaltrials
    NCT00329095 clinicaltrials
    NCT00332059 clinicaltrials
    NCT00332072 clinicaltrials
    NCT00332540 clinicaltrials
    NCT00347802 clinicaltrials
    NCT00347841 clinicaltrials
    NCT00348023 clinicaltrials
    NCT00348062 clinicaltrials
    NCT00355446 clinicaltrials
    NCT00440011 clinicaltrials
    NCT00486486 clinicaltrials
    NCT00538304 clinicaltrials
    NCT00539526 clinicaltrials
    NCT00541242 clinicaltrials
    NCT00651859 clinicaltrials
    NCT00652496 clinicaltrials
    NCT00693420 clinicaltrials
    NCT00705757 clinicaltrials
    NCT00809848 clinicaltrials
    NCT00847483 clinicaltrials
    NCT00907426 clinicaltrials
    NCT00941096 clinicaltrials
    NCT00958035 clinicaltrials
    NCT01001195 clinicaltrials
    NCT01016691 clinicaltrials
    NCT01023841 clinicaltrials
    NCT01064882 clinicaltrials
    NCT01099774 clinicaltrials
    NCT01110499 clinicaltrials
    NCT01157364 clinicaltrials
    NCT01170884 clinicaltrials
    NCT01170884 clinicaltrials
    NCT01177098 clinicaltrials
    NCT01177098 clinicaltrials
    NCT01189279 clinicaltrials
    NCT01200251 clinicaltrials
    NCT01202513 clinicaltrials
    NCT01216943 clinicaltrials
    NCT01217606 clinicaltrials
    NCT01229423 clinicaltrials
    NCT01241240 clinicaltrials
    NCT01243567 clinicaltrials
    NCT01253902 clinicaltrials
    NCT01271686 clinicaltrials
    NCT01291108 clinicaltrials
    NCT01298700 clinicaltrials
    NCT01325337 clinicaltrials
    NCT01325350 clinicaltrials
    NCT01325350 clinicaltrials
    NCT01387906 clinicaltrials
    NCT01391273 clinicaltrials
    NCT01391286 clinicaltrials
    NCT01426113 clinicaltrials
    NCT01448525 clinicaltrials
    NCT01448837 clinicaltrials
    NCT01464424 clinicaltrials
    NCT01525173 clinicaltrials
    NCT01547598 clinicaltrials
    NCT01594970 clinicaltrials
    NCT01655758 clinicaltrials
    NCT01664039 clinicaltrials
    NCT01698554 clinicaltrials
    NCT01765764 clinicaltrials
    NCT01830140 clinicaltrials
    NCT01833741 clinicaltrials
    NCT01863953 clinicaltrials
    NCT01881126 clinicaltrials
    NCT01891487 clinicaltrials
    NCT01904721 clinicaltrials
    NCT01915940 clinicaltrials
    NCT01975714 clinicaltrials
    NCT01978015 clinicaltrials
    NCT02017327 clinicaltrials
    NCT02020512 clinicaltrials
    NCT02059655 clinicaltrials
    NCT02061683 clinicaltrials
    NCT02097719 clinicaltrials
    NCT02143843 clinicaltrials
    NCT02154217 clinicaltrials
    NCT02155049 clinicaltrials
    NCT02170662 clinicaltrials
    NCT02176356 clinicaltrials
    NCT02247804 clinicaltrials
    NCT02250651 clinicaltrials
    NCT02358369 clinicaltrials
    NCT02390284 clinicaltrials
    NCT02444767 clinicaltrials
    NCT02471105 clinicaltrials
    NCT02507687 clinicaltrials
    NCT02537015 clinicaltrials
    NCT02571712 clinicaltrials
    NCT02636946 clinicaltrials
    NCT02676310 clinicaltrials
    NCT02742649 clinicaltrials
    NCT02830776 clinicaltrials
    NCT02848300 clinicaltrials
    NCT02863705 clinicaltrials
    NCT03419715 clinicaltrials
    NCT03487042 clinicaltrials
    NCT03708627 clinicaltrials
    NCT03825380 clinicaltrials
    NCT03850782 clinicaltrials
    NCT03891446 clinicaltrials
    NCT03927443 clinicaltrials
    NCT03966560 clinicaltrials
    NCT04285580 clinicaltrials
    NCT04499248 clinicaltrials
    NCT04738149 clinicaltrials
    NCT04890106 clinicaltrials
    NCT04898387 clinicaltrials
    NCT04898387 clinicaltrials
    NCT04981886 clinicaltrials
    NCT05335122 clinicaltrials
    NCT05397600 clinicaltrials
    NCT05401357 clinicaltrials
    NCT05600673 clinicaltrials
    NCT05729594 clinicaltrials
    NCT06120842 clinicaltrials
    NCT06122090 clinicaltrials
    NCT06267274 clinicaltrials
    Molport-006-167-657 molport
    371 drugcentral
    220120 bindingdb
    The data in this table is sourced from UniChem at EBI.