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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H16O9
Molecular Weight 400.3356
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VERSICONAL ACETATE

SMILES

CC(=O)OCC[C@H](C=O)C1=C(O)C=C2C(=O)C3=CC(O)=CC(O)=C3C(=O)C2=C1O

InChI

InChIKey=YTGNIIJMSNZCOG-SECBINFHSA-N
InChI=1S/C20H16O9/c1-8(22)29-3-2-9(7-21)15-14(25)6-12-17(19(15)27)20(28)16-11(18(12)26)4-10(23)5-13(16)24/h4-7,9,23-25,27H,2-3H2,1H3/t9-/m1/s1

HIDE SMILES / InChI

Molecular Formula C20H16O9
Molecular Weight 400.3356
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 11:10:51 GMT 2023
Edited
by admin
on Sat Dec 16 11:10:51 GMT 2023
Record UNII
VXS2A3TS4O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VERSICONAL ACETATE
Common Name English
2-ANTHRACENEACETALDEHYDE, .ALPHA.-(2-(ACETYLOXY)ETHYL)-9,10-DIHYDRO-1,3,6,8-TETRAHYDROXY-9,10-DIOXO-, (.ALPHA.S)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID30966362
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
PUBCHEM
91827074
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
FDA UNII
VXS2A3TS4O
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY
CAS
52021-61-1
Created by admin on Sat Dec 16 11:10:51 GMT 2023 , Edited by admin on Sat Dec 16 11:10:51 GMT 2023
PRIMARY