(Q3155510)

Isohumulone (English)

20 September 2016

chemical formula

C₂₁H₃₀O₅

1 reference

Isohumulone (English)

20 September 2016

canonical SMILES

CC(C)CC(=O)C1=C(C(C(C1=O)CC=C(C)C)(C(=O)CC=C(C)C)O)O

1 reference

NMR assignment of iso-α-acids from isomerised extracts ofHumulus lupulus L. cones

Isohumulone (English)

20 September 2016

1 reference

has characteristic

bitterness

1 reference

DOI

10.1590/S0100-40422000000100019

Identifiers

InChI

InChI=1S/C21H30O5/c1-12(2)7-9-15-19(24)18(16(22)11-14(5)6)20(25)21(15,26)17(23)10-8-13(3)4/h7-8,14-15,25-26H,9-11H2,1-6H3

1 reference

Isohumulone (English)

QARXXMMQVDCYGZ-UHFFFAOYSA-N

20 September 2016

InChIKey

1 reference

Isohumulone (English)

imported from Wikimedia project

20 September 2016

CAS Registry Number

25522-96-7

2 references

English Wikipedia

InChIKey

QARXXMMQVDCYGZ-UHFFFAOYSA-N

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=25522-96-7

1 reference

Isohumulone (English)

20 September 2016

1 reference

splash10-03di-0029000000-822a5c98f0e459a8a3dd

Isohumulone (English)

20 September 2016

1 reference

MassBank accession ID

MSBNK-BS-BS003208

0 references

SPLASH

0 references

DSSTox substance ID

DTXSID90948427

0 references

DSSTOX compound identifier

DTXCID801376658

0 references

EC number

247-072-1

1 reference

stated in

ECHA Substance Infocard database

ECHA Substance Infocard ID

100.042.778

27 December 2018