B23271257Determine the necessary mass, volume, or concentration for preparing a solution.
| Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
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Basic Description
| Synonyms | MFCD00009620 | NSC-159627 | (3beta)-Urs-12-ene-3,28-diol | AKOS016036269 | EINECS 266-293-4 | URS-12-ENE-3.BETA.,28-DIOL | 3,28-DIHYDROXYURS-12-ENE | SCHEMBL337913 | SR-05000002219 | UNII-W599R31ROT | Mal-heptanoic NHS ester | s9551 | SMP1_000309 | URS-12 |
|---|---|
| Specifications & Purity | ≥95% |
| Storage Temp | Protected from light,Store at -20°C |
| Shipped In | Ice chest + Ice pads |
Associated Targets(Human)
HSD11B2 Tchem Corticosteroid 11-beta-dehydrogenase isozyme 2 (0 Activities)
HSD11B1 Tclin Corticosteroid 11-beta-dehydrogenase isozyme 1 (0 Activities)
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PTPN1 Tchem Tyrosine-protein phosphatase non-receptor type 1 (0 Activities)
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SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (0 Activities)
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SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (0 Activities)
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SENP1 Tchem Sentrin-specific protease 1 (0 Activities)
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RELA Tchem Transcription factor p65 (0 Activities)
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TOP1 Tclin DNA topoisomerase 1 (0 Activities)
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PTGS1 Tclin Prostaglandin G/H synthase 1 (0 Activities)
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PTGS2 Tclin Prostaglandin G/H synthase 2 (0 Activities)
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ALOX5 Tclin Arachidonate 5-lipoxygenase (0 Activities)
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ALOX15B Tchem Arachidonate 15-lipoxygenase B (0 Activities)
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NR1H4 Tclin Bile acid receptor (0 Activities)
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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (0 Activities)
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GPBAR1 Tchem G-protein coupled bile acid receptor 1 (0 Activities)
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ALOX5 Tclin Arachidonate 5-lipoxygenase (6568 Activities)
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TOP1 Tclin DNA topoisomerase I (7553 Activities)
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PTGS1 Tclin Cyclooxygenase-1 (9233 Activities)
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PTGS2 Tclin Cyclooxygenase-2 (13999 Activities)
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ALOX15B Tchem Arachidonate 15-lipoxygenase, type II (7244 Activities)
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NR1H4 Tclin Bile acid receptor FXR (6228 Activities)
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HT-29 (80576 Activities)
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MCF7 (126967 Activities)
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OVCAR-3 (48710 Activities)
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PANC-1 (6144 Activities)
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WI-38 VA13 (346 Activities)
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A549 (127892 Activities)
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HCT-116 (91556 Activities)
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HepG2 (196354 Activities)
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A2780 (11979 Activities)
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KB (17409 Activities)
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MDA-MB-435 (38290 Activities)
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MDA-MB-231 (73002 Activities)
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RELA Tchem Nuclear factor NF-kappa-B p65 subunit (627 Activities)
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Lu1 (576 Activities)
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GPBAR1 Tchem G-protein coupled bile acid receptor 1 (1723 Activities)
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TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)
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SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)
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SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)
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Associated Targets(non-human)
Hsd11b1 11-beta-hydroxysteroid dehydrogenase 1 (202 Activities)
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Hsd11b2 11-beta-hydroxysteroid dehydrogenase 2 (82 Activities)
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Ptpn1 Protein-tyrosine phosphatase 1B (270 Activities)
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Pseudomonas aeruginosa (123386 Activities)
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Staphylococcus aureus (210822 Activities)
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Escherichia coli (133304 Activities)
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Enterococcus faecalis (29875 Activities)
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Bacillus cereus (7522 Activities)
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Trypanosoma brucei (78846 Activities)
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Trypanosoma brucei brucei (13300 Activities)
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Candida albicans (78123 Activities)
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Trypanosoma cruzi (99888 Activities)
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Human immunodeficiency virus 1 (70413 Activities)
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B16 (5829 Activities)
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RAW264.7 (28094 Activities)
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J774 (3120 Activities)
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Mechanisms of Action
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Names and Identifiers
| IUPAC Name | (3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol |
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| INCHI | InChI=1S/C30H50O2/c1-19-10-15-30(18-31)17-16-28(6)21(25(30)20(19)2)8-9-23-27(5)13-12-24(32)26(3,4)22(27)11-14-29(23,28)7/h8,19-20,22-25,31-32H,9-18H2,1-7H3/t19-,20+,22+,23-,24+,25+,27+,28-,29-,30-/m1/s1 |
| InChi Key | XUARCIYIVXVTAE-ZAPOICBTSA-N |
| Canonical SMILES | CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)O)C)C)C2C1C)C)CO |
| Isomeric SMILES | C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C)CO |
| PubChem CID | 92802 |
| Molecular Weight | 442.72 |
Certificates
Certificate of Analysis(COA)
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Chemical and Physical Properties
| Sensitivity | Light sensitive |
|---|---|
| Melt Point(°C) | 223-225° C (lit.) |