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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H18O3
Molecular Weight 246.3016
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 8-EPI-XANTHATIN

SMILES

C[C@H]1C[C@H]2OC(=O)C(=C)[C@H]2CC=C1\C=C\C(C)=O

InChI

InChIKey=RBRPTFMVULVGIC-MDKNCZOUSA-N
InChI=1S/C15H18O3/c1-9-8-14-13(11(3)15(17)18-14)7-6-12(9)5-4-10(2)16/h4-6,9,13-14H,3,7-8H2,1-2H3/b5-4+/t9-,13+,14+/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H18O3
Molecular Weight 246.3016
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
(-)-Xanthatin up-regulation of the GADD45γ tumor suppressor gene in MDA-MB-231 breast cancer cells: role of topoisomerase IIα inhibition and reactive oxygen species.
2013-03-08
(-)-Xanthatin induces the prolonged expression of c-Fos through an N-acetyl-L-cysteine (NAC)-sensitive mechanism in human breast cancer MDA-MB-231 cells.
2013
(--)-Xanthatin selectively induces GADD45γ and stimulates caspase-independent cell death in human breast cancer MDA-MB-231 cells.
2011-06-20
Substance Class Chemical
Created
by admin
on Wed Apr 02 10:21:29 GMT 2025
Edited
by admin
on Wed Apr 02 10:21:29 GMT 2025
Record UNII
8DFW6D5G55
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(+)-8-EPI-XANTHATIN
Preferred Name English
8-EPI-XANTHATIN
Common Name English
2H-CYCLOHEPTA(B)FURAN-2-ONE, 3,3A,4,7,8,8A-HEXAHYDRO-7-METHYL-3-METHYLENE-6-((1E)-3-OXO-1-BUTEN-1-YL)-, (3AR,7S,8AR)-
Systematic Name English
2H-CYCLOHEPTA(B)FURAN-2-ONE, 3,3A,4,7,8,8A-HEXAHYDRO-7-METHYL-3-METHYLENE-6-(3-OXO-1-BUTENYL)-, (3AR,6(E),7S,8AR)-
Systematic Name English
2H-CYCLOHEPTA(B)FURAN-2-ONE, 3,3A,4,7,8,8A-HEXAHYDRO-7-METHYL-3-METHYLENE-6-(3-OXO-1-BUTENYL)-, (3AR-(3A.ALPHA.,6(E),7.BETA.,8A.ALPHA.))-
Systematic Name English
Code System Code Type Description
FDA UNII
8DFW6D5G55
Created by admin on Wed Apr 02 10:21:29 GMT 2025 , Edited by admin on Wed Apr 02 10:21:29 GMT 2025
PRIMARY
CAS
30890-35-8
Created by admin on Wed Apr 02 10:21:29 GMT 2025 , Edited by admin on Wed Apr 02 10:21:29 GMT 2025
PRIMARY
PUBCHEM
11694445
Created by admin on Wed Apr 02 10:21:29 GMT 2025 , Edited by admin on Wed Apr 02 10:21:29 GMT 2025
PRIMARY