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Details

Stereochemistry ACHIRAL
Molecular Formula C17H18O5
Molecular Weight 302.3218
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-((1E)-2-(3,4,5-TRIMETHOXYPHENYL)ETHENYL)-1,2-BENZENEDIOL

SMILES

COC1=CC(\C=C\C2=CC=C(O)C(O)=C2)=CC(OC)=C1OC

InChI

InChIKey=AUHJKSXBAYVKEG-SNAWJCMRSA-N
InChI=1S/C17H18O5/c1-20-15-9-12(10-16(21-2)17(15)22-3)5-4-11-6-7-13(18)14(19)8-11/h4-10,18-19H,1-3H3/b5-4+

HIDE SMILES / InChI

Molecular Formula C17H18O5
Molecular Weight 302.3218
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:42:14 UTC 2023
Edited
by admin
on Sat Dec 16 16:42:14 UTC 2023
Record UNII
PT7A64BA71
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-((1E)-2-(3,4,5-TRIMETHOXYPHENYL)ETHENYL)-1,2-BENZENEDIOL
Systematic Name English
COMBRESTATIN A4 METABOLITE M4
Common Name English
1,2-BENZENEDIOL, 4-((1E)-2-(3,4,5-TRIMETHOXYPHENYL)ETHENYL)-
Systematic Name English
Code System Code Type Description
CAS
1005788-23-7
Created by admin on Sat Dec 16 16:42:14 UTC 2023 , Edited by admin on Sat Dec 16 16:42:14 UTC 2023
PRIMARY
PUBCHEM
22349258
Created by admin on Sat Dec 16 16:42:14 UTC 2023 , Edited by admin on Sat Dec 16 16:42:14 UTC 2023
PRIMARY
FDA UNII
PT7A64BA71
Created by admin on Sat Dec 16 16:42:14 UTC 2023 , Edited by admin on Sat Dec 16 16:42:14 UTC 2023
PRIMARY
Related Record Type Details
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