(Q27103690)

6-methoxy-2-all-trans-octaprenyl-1,4-benzoquinone (English)

5 October 2016

chemical formula

C₄₇H₇₀O₃

1 reference

6-methoxy-2-all-trans-octaprenyl-1,4-benzoquinone (English)

5 October 2016

canonical SMILES

CC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCCC(=CCC1=CC(=O)C=C(C1=O)OC)C)C)C)C)C)C)C)C

1 reference

6-methoxy-2-all-trans-octaprenyl-1,4-benzoquinone (English)

5 October 2016

isomeric SMILES

CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC1=CC(=O)C=C(C1=O)OC)/C)/C)/C)/C)/C)/C)/C)C

1 reference

6-methoxy-2-all-trans-octaprenyl-1,4-benzoquinone (English)

InChI=1S/C47H70O3/c1-36(2)18-11-19-37(3)20-12-21-38(4)22-13-23-39(5)24-14-25-40(6)26-15-27-41(7)28-16-29-42(8)30-17-31-43(9)32-33-44-34-45(48)35-46(50-10)47(44)49/h18,20,22,24,26,28,30,32,34-35H,11-17,19,21,23,25,27,29,31,33H2,1-10H3/b37-20+,38-22+,39-24+,40-26+,41-28+,42-30+,43-32+

5 October 2016

Identifiers

InChI

1 reference

6-methoxy-2-all-trans-octaprenyl-1,4-benzoquinone (English)

AFTBILPWMUSGIN-MYCGWMCTSA-N

5 October 2016

InChIKey

2 references

6-methoxy-2-all-trans-octaprenyl-1,4-benzoquinone (English)

5 October 2016

stated in

ChEBI release 2020-09-01

1 reference

2-Methoxy-6-[(2E,6E,10E,14E,18E,22E,26E)-3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctaen-1-yl]-1,4-benzoquinone (English)

5 October 2016

2 references

6-methoxy-2-all-trans-octaprenyl-1,4-benzoquinone (English)

matched by identifier from

5 October 2016

InChIKey

AFTBILPWMUSGIN-MYCGWMCTSA-N

ChEBI ID

28423

mapping relation type

2 references

6-methoxy-2-octaprenyl-1,4-benzoquinone (English)