(Q27224949)

Spectrum_001510 (English)

[(9R)-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-h]chromen-9-yl] (E)-2-methylbut-2-enoate

12 October 2016

stereoisomer of

1 reference

[(9S)-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-h]chromen-9-yl] (E)-2-methylbut-2-enoate

2 references

[(9S)-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-h]chromen-9-yl] (Z)-2-methylbut-2-enoate

inferred from InChI

2 references

2 references

inferred from InChI

chemical formula

C₁₉H₂₀O₅

1 reference

Spectrum_001510 (English)

12 October 2016

canonical SMILES

CC=C(C)C(=O)OC1CC2=C(C=CC3=C2OC(=O)C=C3)OC1(C)C

1 reference

Spectrum_001510 (English)

12 October 2016

isomeric SMILES

CC=C(C)C(=O)O[C@@H]1CC2=C(C=CC3=C2OC(=O)C=C3)OC1(C)C

1 reference

Spectrum_001510 (English)

InChI=1S/C19H20O5/c1-5-11(2)18(21)22-15-10-13-14(24-19(15,3)4)8-6-12-7-9-16(20)23-17(12)13/h5-9,15H,10H2,1-4H3/t15-/m1/s1

12 October 2016

Identifiers

InChI

1 reference

Spectrum_001510 (English)

RRHCDWLSHIIIIT-OAHLLOKOSA-N

12 October 2016

InChIKey

2 references

Spectrum_001510 (English)

12 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(9R)-8,8-Dimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-9-yl 2-methyl-2-butenoate (English)

12 October 2016

2 references

Spectrum_001510 (English)

matched by identifier from

12 October 2016

InChIKey

RRHCDWLSHIIIIT-OAHLLOKOSA-N

ChEBI ID

131175

mapping relation type

2 references

2-methyl-2-butenoic acid [(9R)-8,8-dimethyl-2-oxo-9,10-dihydropyrano[2,3-h][1]benzopyran-9-yl] ester (English)