(Q27149455)

Thiothece-474 (English)

8 October 2016

chemical formula

C₄₁H₅₈O₂

1 reference

Thiothece-474 (English)

8 October 2016

canonical SMILES

CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC=CC=C(C)C=CC=C(C)C=CC=C(C)C(=O)CCC(C)(C)OC)C)C

1 reference

Thiothece-474 (English)

8 October 2016

isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C(=O)CCC(C)(C)OC)/C)/C

1 reference

Thiothece-474 (English)

Bacterial carotenoids. XXXVII. Carotenoids of thiorhodaceae 9. Structural elucidation of five minor carotenoids from thiothece gelatinosa.

8 October 2016

found in taxon

Thiocystis gelatinosa

1 reference

stated in

Identifiers

InChI

InChI=1S/C41H58O2/c1-32(20-14-22-34(3)24-16-25-37(6)39(42)29-31-41(9,10)43-11)18-12-13-19-33(2)21-15-23-35(4)27-28-38-36(5)26-17-30-40(38,7)8/h12-16,18-25,27-28H,17,26,29-31H2,1-11H3/b13-12+,20-14+,21-15+,24-16+,28-27+,32-18+,33-19+,34-22+,35-23+,37-25+

1 reference

Thiothece-474 (English)

8 October 2016

2 references

Thiothece-474 (English)

8 October 2016

stated in

ChEBI release 2020-09-01

1 reference

1'-Methoxy-1',2'-dihydro-beta,psi-caroten-4'-one (English)

8 October 2016

2 references

Thiothece-474 (English)

matched by identifier from

8 October 2016

ChEBI ID

80416

mapping relation type

2 references

Thiothece-474 (English)

matched by identifier from

8 October 2016

International Chemical Identifier

InChI

InChI=1S/C41H58O2/c1-32(20-14-22-34(3)24-16-25-37(6)39(42)29-31-41(9,10)43-11)18-12-13-19-33(2)21-15-23-35(4)27-28-38-36(5)26-17-30-40(38,7)8/h12-16,18-25,27-28H,17,26,29-31H2,1-11H3/b13-12+,20-14+,21-15+,24-16+,28-27+,32-18+,33-19+,34-22+,35-23+,37-25+

1 reference

3 references

Thiothece-474 (English)

matched by identifier from

8 October 2016

based on heuristic

inferred from InChIKey

1 reference

http://www.lipidmaps.org/rest/compound/lm_id/LM/all/download

Thiothece-474 (English)

8 October 2016

1 reference

31 December 2022