Hypothemycin
Hypothemycin structure
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Common Name | Hypothemycin | ||
|---|---|---|---|---|
| CAS Number | 76958-67-3 | Molecular Weight | 378.37300 | |
| Density | 1.343g/cm3 | Boiling Point | 673.1ºC at 760 mmHg | |
| Molecular Formula | C19H22O8 | Melting Point | 170-172℃ | |
| MSDS | Chinese USA | Flash Point | 242.7ºC | |
Use of HypothemycinHypothemycin, a fungal polyketide, is a multikinase inhibitor with Kis of 10/70 nM, 17/38 nM, 90 nM, 900 nM/1.5 μM, and 8.4/2.4 μM for VEGFR2/VEGFR1, MEK1/MEK2, FLT-3, PDGFRβ/PDGFRα, and ERK1/ERK2, respectively[1][2]. |
| Name | hypothemycin |
|---|---|
| Synonym | More Synonyms |
| Description | Hypothemycin, a fungal polyketide, is a multikinase inhibitor with Kis of 10/70 nM, 17/38 nM, 90 nM, 900 nM/1.5 μM, and 8.4/2.4 μM for VEGFR2/VEGFR1, MEK1/MEK2, FLT-3, PDGFRβ/PDGFRα, and ERK1/ERK2, respectively[1][2]. |
|---|---|
| Related Catalog | |
| Target |
VEGFR2:10 nM (Ki) VEGFR1:70 nM (Ki) MEK1:17 nM (Ki) MEK2:38 nM (Ki) FLT-3:90 nM (Ki) PDGFRα:1.5 μM (Ki) PDGFRβ:900 nM (Ki) ERK1:8.4 μM (Ki) ERK2:2.4 μM (Ki) |
| In Vitro | Hypothemycin inhibits eosinophilic EOL1 cell carrying mutations in FIP1L1-PDGFRα, acute myeloid leukemia MV-4-11 cell carrying mutations in FLT3-ITD, melanoma COLO829 cell carrying mutations in BRAF V600E, HUVEC cell carrying mutations in VEGFR, mastocytoma P815 cell carrying mutations in c-KIT D814Y, NSCLC A459 cell carrying mutations in KRAS, and ovarian SKOV-3 cell carrying mutations in HER2 with IC50s of 0.4 nM, 6 nM, 50 nM, 70 nM, 370 nM, 6.0 μM, and 7.0 μM, respectively[2]. |
| In Vivo | Hypothemycin (10 mg/kg) kills T. brucei in infected mice, completely curing the infection in one third of animals, although high doses of Hypothemycin (>10 mg/kg) leads to side effects[1]. Animal Model: Adult female Balb/c mice (weighing 18–22 g) infected with T. brucei[1] Dosage: 10 mg/kg Administration: Administered once daily via intraperitoneal injection for 7 days. Result: Showed a dose-dependent reduction in parasitemia in infected mice. Prolonged survival of infected mice over 30 days, with a cure rate of 33%. |
| References |
| Density | 1.343g/cm3 |
|---|---|
| Boiling Point | 673.1ºC at 760 mmHg |
| Melting Point | 170-172℃ |
| Molecular Formula | C19H22O8 |
| Molecular Weight | 378.37300 |
| Flash Point | 242.7ºC |
| Exact Mass | 378.13100 |
| PSA | 125.82000 |
| LogP | 1.02690 |
| Index of Refraction | 1.573 |
| Storage condition | 20°C |
|
~16%
Hypothemycin CAS#:76958-67-3 |
| Literature: Selles, Patrice; Lett, Robert Tetrahedron Letters, 2002 , vol. 43, # 26 p. 4627 - 4631 |
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~%
Hypothemycin CAS#:76958-67-3 |
| Literature: Selles, Patrice; Lett, Robert Tetrahedron Letters, 2002 , vol. 43, # 26 p. 4627 - 4631 |
|
~%
Hypothemycin CAS#:76958-67-3 |
| Literature: Selles, Patrice; Lett, Robert Tetrahedron Letters, 2002 , vol. 43, # 26 p. 4627 - 4631 |
|
~%
Hypothemycin CAS#:76958-67-3 |
| Literature: Selles, Patrice; Lett, Robert Tetrahedron Letters, 2002 , vol. 43, # 26 p. 4627 - 4631 |
|
~%
Hypothemycin CAS#:76958-67-3 |
| Literature: Selles, Patrice; Lett, Robert Tetrahedron Letters, 2002 , vol. 43, # 26 p. 4627 - 4631 |
|
~%
Hypothemycin CAS#:76958-67-3 |
| Literature: Selles, Patrice; Lett, Robert Tetrahedron Letters, 2002 , vol. 43, # 26 p. 4627 - 4631 |
|
~%
Hypothemycin CAS#:76958-67-3 |
| Literature: Selles, Patrice; Lett, Robert Tetrahedron Letters, 2002 , vol. 43, # 26 p. 4627 - 4631 |
![(3aR,5Z,8S,15E)-4,11-dihydroxy-13-methoxy-2,2,8-trimethyl-3a,4,7,8,17,17a-hexahydro-10H-benzo[c][1,3]dioxolo[4,5-h][1]oxacyclotetradecin-10-one structure](https://image.chemsrc.com/caspic/407/460358-69-4.png)
![(3aR,4R,5Z,8S,15E)-4,11-dihydroxy-13-methoxy-2,2,8-trimethyl-3a,4,7,8,17,17a-hexahydro-10H-benzo[c][1,3]dioxolo[4,5-h][1]oxacyclotetradecin-10-one structure](https://image.chemsrc.com/caspic/276/460358-77-4.png)
| Precursor 2 | |
|---|---|
| DownStream 0 | |
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Name: Cytotoxicity against human MDA-MB-435 cells after 72 hrs by MTS assay
Source: ChEMBL
Target: MDA-MB-435
External Id: CHEMBL1804146
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Name: Cytotoxicity against human SF268 cells after 72 hrs by MTS assay
Source: ChEMBL
Target: SF-268
External Id: CHEMBL1804145
|
|
Name: Inhibition of PKD1 (unknown origin)
Source: ChEMBL
Target: Serine/threonine-protein kinase D1
External Id: CHEMBL5316849
|
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Name: Reversible inhibition of recombinant human GSK-3beta at 70 uM preincubated for 3 hrs ...
Source: ChEMBL
Target: Glycogen synthase kinase-3 beta
External Id: CHEMBL4822932
|
|
Name: Reversible inhibition of recombinant human GSK-3beta at 20 uM preincubated for 3 hrs ...
Source: ChEMBL
Target: Glycogen synthase kinase-3 beta
External Id: CHEMBL4822933
|
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Name: Inhibition of TAK1 (unknown origin)
Source: ChEMBL
Target: Mitogen-activated protein kinase kinase kinase 7
External Id: CHEMBL3632095
|
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Name: Binding affinity to wild type FLT3 (unknown origin) assessed as covalent modification...
Source: ChEMBL
Target: Receptor-type tyrosine-protein kinase FLT3
External Id: CHEMBL4401403
|
|
Name: Cytotoxicity against human HT-29 cells after 72 hrs by MTS assay
Source: ChEMBL
Target: HT-29
External Id: CHEMBL1804008
|
|
Name: Inhibition of recombinant human N-terminal GST-tagged TAK1 (1 to 303 residues)/TAB1 (...
Source: ChEMBL
Target: TGF-beta-activated kinase 1 and MAP3K7-binding protein 1
External Id: CHEMBL5125407
|
|
Name: Cytotoxicity against human OVCAR-3 cells assessed as reduction in cell viability meas...
Source: ChEMBL
Target: OVCAR-3
External Id: CHEMBL5125408
|
| (1aR,3S,4S,6Z,9S,15bR)-1a,8,9,15b-Tetrahydro-3,4,12-trihydroxy-9-methyl-14-methoxy-3H-oxireno[k][2]benzoxacyclotetradecin-5,11(2H,4H)-dione |
| MFCD08457932 |
| Hypothemicin |
| (1aR,3S,4S,6Z,9S,15bR)-1a,2,4,5,11,8,9,15b-Octahydro-3,4,12-trihydroxy-9-methyl-14-methoxy-3H-oxireno[k][2]benzoxacyclotetradecin-5,11-dione |