(Q27131567)

3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate (English)

3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate

7 October 2016

stereoisomer of

1 reference

3-[(5R,6S)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate

inferred from InChI

1 reference

(E)-3-[(5S,6R)-5,6-dihydroxycyclohexa-1,3-dienyl]acrylate

inferred from InChI

1 reference

inferred from InChI

chemical formula

C₉H₉O₄⁻

1 reference

inferred from SMILES

canonical SMILES

C1=CC(C(C(=C1)C=CC(=O)[O-])O)O

1 reference

3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate (English)

7 October 2016

isomeric SMILES

C1=C[C@H]([C@H](C(=C1)/C=C/C(=O)[O-])O)O

1 reference

3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate (English)

InChI=1S/C9H10O4/c10-7-3-1-2-6(9(7)13)4-5-8(11)12/h1-5,7,9-10,13H,(H,11,12)/p-1/b5-4+/t7-,9+/m1/s1

7 October 2016

Identifiers

InChI

1 reference

3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate (English)

AEUBLTTWYCDTGM-HZMPTLLJSA-M

7 October 2016

InChIKey

2 references

3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(2E)-3-[(5R,6S)-5,6-Dihydroxy-1,3-cyclohexadien-1-yl]acrylate (English)

7 October 2016

1 reference

3-(cis-5,6-dihydroxycyclohexa-1,3-dien-1-yl)prop-2-enoate (English)

7 October 2016

ChEBI ID

62057

mapping relation type

1 reference