U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C16H16O5
Molecular Weight 288.2952
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ALKANNIN

SMILES

CC(C)=CC[C@H](O)C1=CC(=O)C2=C(C(O)=CC=C2O)C1=O

InChI

InChIKey=NEZONWMXZKDMKF-JTQLQIEISA-N
InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3/t10-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H16O5
Molecular Weight 288.2952
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 Fri Dec 15 18:36:01 GMT 2023
Edited
by admin
on Fri Dec 15 18:36:01 GMT 2023
Record UNII
075CRZ9995
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ALKANNIN
MI  
Common Name English
ANCHUSA ACID
Common Name English
5,8-DIHYDROXY-2-((1S)-1-HYDROXY-4-METHYLPENT-3-EN-1-YL)NAPHTHALENE-1,4-DIONE
Systematic Name English
ANCHUSIN
Common Name English
C.I. NATURAL RED 20
Common Name English
ALKANNIN [MI]
Common Name English
ALKANNA RED
Common Name English
(-)-5,8-DIHYDROXY-2-(1-HYDROXY-4-METHYL-3-PENTENYL)-1,4-NAPHTHOQUINONE
Systematic Name English
NSC-94524
Code English
Code System Code Type Description
NSC
94524
Created by admin on Fri Dec 15 18:36:01 GMT 2023 , Edited by admin on Fri Dec 15 18:36:01 GMT 2023
PRIMARY
ECHA (EC/EINECS)
208-245-7
Created by admin on Fri Dec 15 18:36:01 GMT 2023 , Edited by admin on Fri Dec 15 18:36:01 GMT 2023
PRIMARY
CAS
517-88-4
Created by admin on Fri Dec 15 18:36:01 GMT 2023 , Edited by admin on Fri Dec 15 18:36:01 GMT 2023
PRIMARY
PUBCHEM
72521
Created by admin on Fri Dec 15 18:36:01 GMT 2023 , Edited by admin on Fri Dec 15 18:36:01 GMT 2023
PRIMARY
WIKIPEDIA
ALKANNIN
Created by admin on Fri Dec 15 18:36:01 GMT 2023 , Edited by admin on Fri Dec 15 18:36:01 GMT 2023
PRIMARY
EPA CompTox
DTXSID201029621
Created by admin on Fri Dec 15 18:36:01 GMT 2023 , Edited by admin on Fri Dec 15 18:36:01 GMT 2023
PRIMARY
MERCK INDEX
m1519
Created by admin on Fri Dec 15 18:36:01 GMT 2023 , Edited by admin on Fri Dec 15 18:36:01 GMT 2023
PRIMARY Merck Index
FDA UNII
075CRZ9995
Created by admin on Fri Dec 15 18:36:01 GMT 2023 , Edited by admin on Fri Dec 15 18:36:01 GMT 2023
PRIMARY
MESH
C018204
Created by admin on Fri Dec 15 18:36:01 GMT 2023 , Edited by admin on Fri Dec 15 18:36:01 GMT 2023
PRIMARY