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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H20O6
Molecular Weight 356.3692
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DEOXYHERQUEINONE

SMILES

COC1=C(O)C2=C(O)C3=C(O[C@H](C)C3(C)C)C4=C(C)C=C(O)C(C1=O)=C24

InChI

InChIKey=XXKJBDTZZBQBCP-MRVPVSSYSA-N
InChI=1S/C20H20O6/c1-7-6-9(21)11-12-10(7)18-14(20(3,4)8(2)26-18)15(22)13(12)17(24)19(25-5)16(11)23/h6,8,21-22,24H,1-5H3/t8-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H20O6
Molecular Weight 356.3692
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:52:39 GMT 2023
Edited
by admin
on Sat Dec 16 12:52:39 GMT 2023
Record UNII
B26A9D4ZI0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DEOXYHERQUEINONE
Common Name English
HERQUEINONE, DEOXY-
Common Name English
4H-PHENALENO(1,2-B)FURAN-4-ONE, 8,9-DIHYDRO-3,6,7-TRIHYDROXY-5-METHOXY-1,8,8,9-TETRAMETHYL-, (9R)-
Systematic Name English
(9R)-8,9-DIHYDRO-3,6,7-TRIHYDROXY-5-METHOXY-1,8,8,9-TETRAMETHYL-4H-PHENALENO(1,2-B)FURAN-4-ONE
Systematic Name English
DEOXYHERQUEINONE,(+)-
Common Name English
(+)-DEOXYHERQUEINONE
Common Name English
Code System Code Type Description
FDA UNII
B26A9D4ZI0
Created by admin on Sat Dec 16 12:52:39 GMT 2023 , Edited by admin on Sat Dec 16 12:52:39 GMT 2023
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EPA CompTox
DTXSID501043698
Created by admin on Sat Dec 16 12:52:39 GMT 2023 , Edited by admin on Sat Dec 16 12:52:39 GMT 2023
PRIMARY
CHEBI
145874
Created by admin on Sat Dec 16 12:52:39 GMT 2023 , Edited by admin on Sat Dec 16 12:52:39 GMT 2023
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PUBCHEM
135565746
Created by admin on Sat Dec 16 12:52:39 GMT 2023 , Edited by admin on Sat Dec 16 12:52:39 GMT 2023
PRIMARY
CAS
20887-73-4
Created by admin on Sat Dec 16 12:52:39 GMT 2023 , Edited by admin on Sat Dec 16 12:52:39 GMT 2023
PRIMARY
CHEBI
145901
Created by admin on Sat Dec 16 12:52:39 GMT 2023 , Edited by admin on Sat Dec 16 12:52:39 GMT 2023
PRIMARY