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Details

Stereochemistry RACEMIC
Molecular Formula C26H30O4
Molecular Weight 406.514
Optical Activity ( + / - )
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PANDURATIN A

SMILES

COC1=CC(O)=C(C(=O)[C@@H]2[C@H](CC=C(C)C)C(C)=CC[C@H]2C3=CC=CC=C3)C(O)=C1

InChI

InChIKey=LYDZCXVWCFJAKQ-ZFGGDYGUSA-N
InChI=1S/C26H30O4/c1-16(2)10-12-20-17(3)11-13-21(18-8-6-5-7-9-18)24(20)26(29)25-22(27)14-19(30-4)15-23(25)28/h5-11,14-15,20-21,24,27-28H,12-13H2,1-4H3/t20-,21+,24-/m1/s1

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Induction of apoptosis and cell cycle arrest by a chalcone panduratin A isolated from Kaempferia pandurata in androgen-independent human prostate cancer cells PC3 and DU145.
2006 Jul
Name Type Language
PANDURATIN A
INCI  
INCI  
Official Name English
METHANONE, (2,6-DIHYDROXY-4-METHOXYPHENYL)((1R,2S,6R)-3-METHYL-2-(3-METHYL-2-BUTENYL)-6-PHENYL-3-CYCLOHEXEN-1-YL)-, REL-
Common Name English
PANOID
Brand Name English
METHANONE, (2,6-DIHYDROXY-4-METHOXYPHENYL)((1R,2S,6R)-3-METHYL-2-(3-METHYL-2-BUTEN-1-YL)-6-PHENYL-3-CYCLOHEXEN-1-YL)-, REL-
Common Name English
METHANONE, (2,6-DIHYDROXY-4-METHOXYPHENYL)(3-METHYL-2-(3-METHYL-2-BUTENYL)-6-PHENYL-3-CYCLOHEXEN-1-YL)-, (1.ALPHA.,2.ALPHA.,6.BETA.)-
Common Name English
PANDURATIN A [INCI]
Common Name English
(±)-PANDURATIN A
Common Name English
METHANONE, (2,6-DIHYDROXY-4-METHOXYPHENYL)(3-METHYL-2-(3-METHYL-2-BUTENYL)-6-PHENYL-3-CYCLOHEXEN-1-YL)-, (1.ALPHA.,2.ALPHA.,6.BETA.)-(±)-
Common Name English
Code System Code Type Description
FDA UNII
27N2BIM2CR
Created by admin on Sat Dec 16 20:18:38 GMT 2023 , Edited by admin on Sat Dec 16 20:18:38 GMT 2023
PRIMARY
MESH
C482884
Created by admin on Sat Dec 16 20:18:38 GMT 2023 , Edited by admin on Sat Dec 16 20:18:38 GMT 2023
PRIMARY
CAS
89837-52-5
Created by admin on Sat Dec 16 20:18:38 GMT 2023 , Edited by admin on Sat Dec 16 20:18:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID20237917
Created by admin on Sat Dec 16 20:18:38 GMT 2023 , Edited by admin on Sat Dec 16 20:18:38 GMT 2023
PRIMARY
PUBCHEM
6483648
Created by admin on Sat Dec 16 20:18:38 GMT 2023 , Edited by admin on Sat Dec 16 20:18:38 GMT 2023
PRIMARY