Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C21H27ClO5 |
Molecular Weight | 394.889 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(C1=CC=C(OC[C@H](O)CO)C=C1)C2=CC=C(OC[C@H](O)CCl)C=C2
InChI
InChIKey=HDTYUHNZRYZEEB-QZTJIDSGSA-N
InChI=1S/C21H27ClO5/c1-21(2,15-3-7-19(8-4-15)26-13-17(24)11-22)16-5-9-20(10-6-16)27-14-18(25)12-23/h3-10,17-18,23-25H,11-14H2,1-2H3/t17-,18-/m1/s1
Approval Year
Targets
Primary Target | Pharmacology | Condition | Potency |
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Target ID: CHEMBL1871 Sources: https://www.ncbi.nlm.nih.gov/pubmed/20541699 | |
6.0 µM [IC50] |
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C242
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DTXSID901019057
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C152147
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Ralaniten
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10676
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ACTIVE MOIETY