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Details

Stereochemistry ABSOLUTE
Molecular Formula C19H22O4
Molecular Weight 314.3763
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NORISOGUAIACIN

SMILES

C[C@]1([H])Cc2cc(c(cc2[C@]([H])([C@]1([H])C)c3ccc(c(c3)OC)O)O)O

InChI

InChIKey=OOLXLJYOMPTXOB-XCJKDKRRSA-N
InChI=1S/C19H22O4/c1-10-6-13-7-16(21)17(22)9-14(13)19(11(10)2)12-4-5-15(20)18(8-12)23-3/h4-5,7-11,19-22H,6H2,1-3H3/t10-,11-,19-/m1/s1

HIDE SMILES / InChI

Molecular Formula C19H22O4
Molecular Weight 314.3763
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Jun 26 06:29:59 UTC 2021
Edited
by admin
on Sat Jun 26 06:29:59 UTC 2021
Record UNII
4O99323A5X
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NORISOGUAIACIN
Common Name English
2,3-NAPHTHALENEDIOL, 5,6,7,8-TETRAHYDRO-5-(4-HYDROXY-3-METHOXYPHENYL)-6,7-DIMETHYL-, (5R-(5.ALPHA.,6.BETA.,7.BETA.))-
Common Name English
2,3-NAPHTHALENEDIOL, 5,6,7,8-TETRAHYDRO-5-(4-HYDROXY-3-METHOXYPHENYL)-6,7-DIMETHYL-, (5R,6R,7R)-
Systematic Name English
6-O-DEMETHYLISOGUAIACIN
Common Name English
Code System Code Type Description
FDA UNII
4O99323A5X
Created by admin on Sat Jun 26 06:29:59 UTC 2021 , Edited by admin on Sat Jun 26 06:29:59 UTC 2021
PRIMARY
CAS
50376-42-6
Created by admin on Sat Jun 26 06:29:59 UTC 2021 , Edited by admin on Sat Jun 26 06:29:59 UTC 2021
PRIMARY
PUBCHEM
170835
Created by admin on Sat Jun 26 06:29:59 UTC 2021 , Edited by admin on Sat Jun 26 06:29:59 UTC 2021
PRIMARY
EPA CompTox
50376-42-6
Created by admin on Sat Jun 26 06:29:59 UTC 2021 , Edited by admin on Sat Jun 26 06:29:59 UTC 2021
PRIMARY
Related Record Type Details
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