Obacunone - Analytical reference, high purity , CAS No.751-03-1

Item Number
O304552
Grouped product items
SKUSizeAvailabilityPrice Qty
O304552-5mg
5mg
In stock
$34.90
O304552-10mg
10mg
In stock
$59.90
O304552-25mg
25mg
In stock
$115.90
O304552-50mg
50mg
In stock
$199.90
O304552-100mg
100mg
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
$329.90
View related series
Terpenoids [Phytochemicals]

Basic Description

SynonymsOBACUNON | AI3-37934 | (1S,3aS,4aR,4bR,6aR,11aR,11bR,13aS)-1-(furan-3-yl)-4b,7,7,11a,13a-pentamethyl-1,6a,7,11a,11b,12,13,13a-octahydrooxepino[4',3':3,4]benzo[1,2-f]oxireno[2,3-d]isochromene-3,5,9(3aH,4bH,6H)-trione | CHEBI:7713 | Casimirolide | Obacunoic
Specifications & Purityanalytical reference
Storage TempStore at 2-8°C,Protected from light
Shipped InWet ice
Gradeanalytical reference
Product Description

Obacunone has cytotoxicity in androgen-dependent human prostate Y cells. Obacunone exerts an antivirulence effect on S. Typhimurium and may serve as a lead compound for development of antivirulence strategies for S. Typhimurium. Obacunone may have the potential to prevent estrogen-responsive breast Y through inhibition of the aromatase enzyme and inflammatory pathways, as well as activation of apoptosis.

Associated Targets(Human)

MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
SW480 (6023 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDA-MB-435 (38290 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MGLL Tchem Monoglyceride lipase (1909 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
ATAD5 Tbio ATPase family AAA domain-containing protein 5 (122566 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Associated Targets(non-human)

Spodoptera frugiperda (784 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
TGR Thioredoxin glutathione reductase (28579 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID

Names and Identifiers

IUPAC Name (1R,2R,4S,7S,8S,11R,12R,18R)-7-(furan-3-yl)-1,8,12,17,17-pentamethyl-3,6,16-trioxapentacyclo[9.9.0.02,4.02,8.012,18]icos-13-ene-5,15,20-trione
INCHI InChI=1S/C26H30O7/c1-22(2)16-12-17(27)25(5)15(23(16,3)9-7-18(28)32-22)6-10-24(4)19(14-8-11-30-13-14)31-21(29)20-26(24,25)33-20/h7-9,11,13,15-16,19-20H,6,10,12H2,1-5H3/t15-,16+,19+,20-,23-,24+,25+,26-/m1/s1
InChi Key MAYJEFRPIKEYBL-OASIGRBWSA-N
Canonical SMILES CC1(C2CC(=O)C3(C(C2(C=CC(=O)O1)C)CCC4(C35C(O5)C(=O)OC4C6=COC=C6)C)C)C
Isomeric SMILES C[C@@]12CC[C@@H]3[C@]4(C=CC(=O)OC([C@@H]4CC(=O)[C@]3([C@@]15[C@H](O5)C(=O)O[C@H]2C6=COC=C6)C)(C)C)C
PubChem CID 119041
Molecular Weight 454.51

Certificates

Certificate of Analysis(COA)

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5 results found

Lot NumberCertificate TypeDateItem
G2215399Certificate of AnalysisJun 04, 2022 O304552
G2215400Certificate of AnalysisJun 04, 2022 O304552
G2215401Certificate of AnalysisJun 04, 2022 O304552
G2215700Certificate of AnalysisJun 04, 2022 O304552
G2215701Certificate of AnalysisJun 04, 2022 O304552

Chemical and Physical Properties

Sensitivitylight sensitive;heat sensitive

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