Herboxidiene

Base Information

Chemical Name:Herboxidiene
CAS No.:142861-00-5
Molecular Formula:C25H42 O6
Molecular Weight:438.605
Hs Code.:2932990090
UNII:QSB7EM5EUD
DSSTox Substance ID:DTXSID101037297
Nikkaji Number:J1.490.386K,J1.457.270H
Wikipedia:Herboxidiene
Wikidata:Q24208836
ChEMBL ID:CHEMBL4212104
Mol file:142861-00-5.mol

Synonyms:GEX 1A;GEX1A compound;GEX1Q1;herboxidiene;TAN 1609;TAN-1609;TAN1609

Suppliers and Price of Herboxidiene

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Cayman Chemical
Herboxidiene
1mg
$ 344.00

Cayman Chemical
Herboxidiene
500μg
$ 215.00

American Custom Chemicals Corporation
HERBOXYDIENE 95.00%
5MG
$ 495.19

AK Scientific
Herboxidiene
1mg
$ 542.00

Total 6 raw suppliers

Chemical Property of Herboxidiene

Chemical Property:

Vapor Pressure:2.92E-15mmHg at 25°C
Boiling Point:567.9°C at 760 mmHg
PKA:4.38±0.10(Predicted)
Flash Point:181.9°C
PSA：88.52000
Density:1.056g/cm³
LogP:4.36290
Storage Temp.:-20°C
Solubility.:Soluble in DMSO or Ethanol
XLogP3:4.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:11
Exact Mass:438.29813906
Heavy Atom Count:31
Complexity:658

Purity/Quality:

98% ^*data from raw suppliers

Herboxidiene ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CCC(OC1C(=CC=CC(C)CC2(C(O2)C(C)C(C(C)O)OC)C)C)CC(=O)O
Isomeric SMILES:C[C@H]1CC[C@@H](O[C@@H]1/C(=C/C=C/[C@@H](C)C[C@@]2([C@H](O2)[C@H](C)[C@H]([C@@H](C)O)OC)C)/C)CC(=O)O
Description Herboxidiene (142861-00-5) is a novel polyketide fermentation product produced by Streptomyces chromofuscus, originally discovered by screening for herbicidal activity. Potent and selective inhibitor of spliceosome subunit SF3b.2?Specifically targets SAP155, a subunit of SF3b responsible for pre-mRNA splicing.3?Displays anti-angiogenic activity via down-regulation of VEGFR-2 and HIF-1α.4?Spliceosome inhibitors have attracted enormous attention due to their potential use in cancer treatment.5
Uses Herboxidiene is an anticancer agent. Herboxidiene is used in the lowering of plasma cholesterol, pre-mRNA splicing-modulatory action and in anti-tumor activity in numerous cell lines. It also exhibits herbicidal properties.

Technology Process of Herboxidiene

There total 82 articles about Herboxidiene which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 98.0%

: 187962-44-3
methyl 2-((2R,5S,6S)-6-((S,2E,4E)-7-((2R,3R)-3-((2R,3R,4R)-4-hydroxy-3-methoxypentan-2-yl)-2-methyloxiran-2-yl)-6-methylhepta-2,4-dien-2-yl)-5-methyltetrahydro-2H-pyran-2-yl)acetate

: 142861-00-5
2-((2R,5S,6S)-6-((S,2E,4E)-7-((2R,3R)-3-((2R,3R,4R)-4-hydroxy-3-methoxypentan-2-yl)-2-methyloxiran-2-yl)-6-methylhepta-2,4-dien-2-yl)-5-methyltetrahydro-2H-pyran-2-yl)acetic acid

Guidance literature:: With trimethyltin(IV) hydroxide; In 1,1-dichloroethane; at 80 ℃; for 6h;
DOI:10.1021/ol102549a

Reference yield: 93.0%

: 1043451-61-1
(+)-herboxidiene ethyl ester

: 142861-00-5
2-((2R,5S,6S)-6-((S,2E,4E)-7-((2R,3R)-3-((2R,3R,4R)-4-hydroxy-3-methoxypentan-2-yl)-2-methyloxiran-2-yl)-6-methylhepta-2,4-dien-2-yl)-5-methyltetrahydro-2H-pyran-2-yl)acetic acid

Guidance literature:: With potassium trimethylsilonate; In tetrahydrofuran; at 20 ℃; for 2.5h; Inert atmosphere;
DOI:10.1039/c7ob00072c

Reference yield: 66.0%

: 949148-96-3
methyl 2-((2R,5S,6S)-6-((S,2E,4E)-7-((2R,3R)-3-((2R,3R,4S)-4-hydroxy-3-methoxypentan-2-yl)-2-methyloxiran-2-yl)-6-methylhepta-2,4-dien-2-yl)-5-methyltetrahydro-2H-pyran-2-yl)acetate

: 118-91-2
ortho-chlorobenzoic acid

: 142861-00-5
2-((2R,5S,6S)-6-((S,2E,4E)-7-((2R,3R)-3-((2R,3R,4R)-4-hydroxy-3-methoxypentan-2-yl)-2-methyloxiran-2-yl)-6-methylhepta-2,4-dien-2-yl)-5-methyltetrahydro-2H-pyran-2-yl)acetic acid

Guidance literature:: methyl 2-((2R,5S,6S)-6-((S,2E,4E)-7-((2R,3R)-3-((2R,3R,4S)-4-hydroxy-3-methoxypentan-2-yl)-2-methyloxiran-2-yl)-6-methylhepta-2,4-dien-2-yl)-5-methyltetrahydro-2H-pyran-2-yl)acetate; ortho-chlorobenzoic acid; With di-isopropyl azodicarboxylate; triphenylphosphine; In benzene; at 20 ℃; for 12h;

With potassium carbonate; In methanol; water; at 40 ℃; Further stages.;
DOI:10.1021/ol701427k