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Details

Stereochemistry ACHIRAL
Molecular Formula C7H8O6
Molecular Weight 188.1348
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of HOMOACONITIC ACID, CIS-

SMILES

OC(=O)CC\C(=C\C(O)=O)C(O)=O

InChI

InChIKey=BJYPZFUWWJSAKC-ARJAWSKDSA-N
InChI=1S/C7H8O6/c8-5(9)2-1-4(7(12)13)3-6(10)11/h3H,1-2H2,(H,8,9)(H,10,11)(H,12,13)/b4-3-

HIDE SMILES / InChI

Molecular Formula C7H8O6
Molecular Weight 188.1348
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
BPE4V564XP
Record Status Validated (UNII)
Record Version