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  1. General Info
  2. Source Info
  3. Effects Info
  4. Reference
Phytochemical Details
01. General Information
Name Brusatol
PubChem CID 73432
Molecular Weight 520.5g/mol
Synonyms

brusatol

Formula C₂₆H₃₂O₁₁
SMILES CC1=C(C(=O)CC2(C1CC3C45C2C(C(C(C4C(C(=O)O3)OC(=O)C=C(C)C)(OC5)C(=O)OC)O)O)C)O
InChI 1S/C26H32O11/c1-10(2)6-15(28)37-18-20-25-9-35-26(20,23(33)34-5)21(31)17(30)19(25)24(4)8-13(27)16(29)11(3)12(24)7-14(25)36-22(18)32/h6,12,14,17-21,29-31H,7-9H2,1-5H3/t12-,14+,17+,18+,19+,20+,21-,24-,25+,26-/m0/s1
InChIKey ZZZYHIMVKOHVIH-VILODJCFSA-N
CAS Number 14907-98-3
ChEMBL ID CHEMBL459546
ChEBI ID CHEBI:3197
Herb ID HBIN018930
KEGG ID C08754
Structure 2D-img
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2D MOL 3D MOL
02. Source Information of Phytochemical
Brucea javanica Cold
Chineses Pinyin YaDanZi
Use Part Fruit
Habitat FuJian, GuangXi, YunNan, TaiWan, GuangDong, FuJian, TaiWan
Flavor Bitter
Meridian Tropism Large intestine, Liver
Species
>Kingdom: Viridiplantae
 -->Phylum: Streptophyta
  -->Class: Equisetopsida
   -->Order: Sapindales
    -->Family: Simaroubaceae
     -->Genus: Brucea
      -->Species: Brucea javanica
03. Combinatorial Therapeutic Effect(s)
Synergistic Effect
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Drug(s) whose efficacy can be enhanced by this phytochemical
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Combination Pair ID: 177
Pair Name Brusatol, Cytarabine
Partner Name Cytarabine
Disease Info [ICD-11: 2A60.Z] Acute myeloid leukemia Investigative
Gene Regulation Down-regulation Expression G6PD hsa2539
Down-regulation Expression NFE2L2 hsa4780
In Vitro Model HL-60 Adult acute myeloid leukemia Homo sapiens (Human) CVCL_0002
THP-1 Childhood acute monocytic leukemia Homo sapiens (Human) CVCL_0006
Result Inhibition of Nrf2-mediated glucose metabolism by brusatol synergistically sensitizes acute myeloid leukemia to Ara-C
Combination Pair ID: 179
Pair Name Brusatol, Cabergoline
Partner Name Cabergoline
Disease Info [ICD-11: 2F37] Pituitary adenomas Investigative
Biological Phenomena Induction-->ROS accumulation
Gene Regulation Down-regulation Phosphorylation EIF4EBP1 hsa1978
Down-regulation Expression RHEB hsa6009
Up-regulation Expression ROS1 hsa6098
Down-regulation Phosphorylation RPS6KB1 hsa6198
In Vitro Model GH3 Rat pituitary gland neoplasm Rattus norvegicus (Rat) CVCL_0273
MMQ Rat pituitary gland neoplasm Rattus norvegicus (Rat) CVCL_2117
In Vivo Model A total of 5×10⁶ of the indicated MMQ and GH3 cells were resuspended in 100 μL PBS buffer mixed with Matrigel (1 : 1) and then subcutaneously injected into the back of each nude mice.
Result Combined use of CAB and BT may increase the clinical effectiveness of treatment for human pituitary adenomas.
Combination Pair ID: 675
Pair Name Brusatol, Cisplatin
Partner Name Cisplatin
Disease Info [ICD-11: 2B91] Colorectal cancer Investigative
Biological Phenomena Induction-->Apoptosis
Gene Regulation Up-regulation Expression BAX hsa581
In Vitro Model CT26 Mouse colon adenocarcinoma Mus musculus (Mouse) CVCL_7254
Result These results strongly suggested that the combination of CDDP and BR was able to produce a synergistic antitumor effect in CRC cells, thus providing a solid foundation for further development of this combination regimen into an effective therapeutic method for CRC.
Drug(s) whose resistance can be reversed by this phytochemical
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Combination Pair ID: 178
Pair Name Brusatol, Gemcitabine
Partner Name Gemcitabine
Disease Info [ICD-11: 2C10] Pancreatic cancer Investigative
Biological Phenomena Induction-->Apoptosis
Gene Regulation Down-regulation Expression ABCB1 hsa5243
Down-regulation Expression ABCC1 hsa4363
Down-regulation Expression ABCC2 hsa1244
Down-regulation Expression ABCC3 hsa8714
Down-regulation Expression ABCC4 KEGG ID N.A.
Down-regulation Expression ABCC5 KEGG ID N.A.
Down-regulation Expression ABCC5 KEGG ID N.A.
Down-regulation Expression HMOX1 hsa3162
Down-regulation Expression NFE2L2 hsa4780
Down-regulation Expression NQO1 hsa1728
Up-regulation Expression ROS1 hsa6098
In Vitro Model PANC-1 Pancreatic ductal adenocarcinoma Homo sapiens (Human) CVCL_0480
BxPC-3 Pancreatic ductal adenocarcinoma Homo sapiens (Human) CVCL_0186
PaTu 8988s Pancreatic adenocarcinoma Homo sapiens (Human) CVCL_1846
In Vivo Model PANC-1 cells (4×10⁶) were resuspended in 100 μL PBS and then subcutaneously injected in the right flank of nude mice.
Result Our results suggest that brusatol is capable of enhancing the antitumour effects of gemcitabine in both pancreatic cancer cells and PANC-1 xenografts via suppressing the Nrf2 pathway.
04. Reference
No. Title Href
1 Inhibition of Nrf2-mediated glucose metabolism by brusatol synergistically sensitizes acute myeloid leukemia to Ara-C. Biomed Pharmacother. 2021 Oct;142:111652. doi: 10.1016/j.biopha.2021.111652. Click
2 Brusatol Inhibits Tumor Growth and Increases the Efficacy of Cabergoline against Pituitary Adenomas. Oxid Med Cell Longev. 2021 Jun 16;2021:6696015. doi: 10.1155/2021/6696015. Click
3 Synergistic antitumor effect of brusatol combined with cisplatin on colorectal cancer cells. Int J Mol Med. 2018 Mar;41(3):1447-1454. doi: 10.3892/ijmm.2018.3372. Click
4 Brusatol Enhances the Chemotherapy Efficacy of Gemcitabine in Pancreatic Cancer via the Nrf2 Signalling PathwayBrusatol Enhances the Chemotherapy Efficacy of Gemcitabine in Pancreatic Cancer via the Nrf2 Signalling Pathway. Oxid Med Cell Longev. 2018 Apr 18;2018:2360427. doi: 10.1155/2018/2360427. Click
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