(Q105290161)

English

acetylenic acids

group of stereoisomers with the chemical formula C₄₀H₆₆O₅

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Statements

instance of

group of stereoisomers

0 references

subclass of

biogenic acyclic ether

1 reference

inferred from

biogenic acyclic ether

mass

626.491025212 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₀H₆₆O₅

0 references

canonical SMILES

O=C(OC(=O)C(OC)CCC#CCCCCCC(C)CCCCC=C)C(OC)CCC#CCCCCCC(C)CCCCC=C

0 references

found in taxon

Stelletta

1 reference

stated in

New Acetylenic Acids from a Sponge of the Genus Stelletta

Identifiers

InChI

InChI=1S/C40H66O5/c1-7-9-11-23-29-35(3)31-25-19-15-13-17-21-27-33-37(43-5)39(41)45-40(42)38(44-6)34-28-22-18-14-16-20-26-32-36(4)30-24-12-10-8-2/h7-8,35-38H,1-2,9-16,19-20,23-34H2,3-6H3

0 references

InChIKey

VOGBKCAANIAXCI-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

VOGBKCAANIAXCI-UHFFFAOYSA-N

ChEBI ID

178363

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C40H66O5/c1-7-9-11-23-29-35(3)31-25-19-15-13-17-21-27-33-37(43-5)39(41)45-40(42)38(44-6)34-28-22-18-14-16-20-26-32-36(4)30-24-12-10-8-2/h7-8,35-38H,1-2,9-16,19-20,23-34H2,3-6H3

SureChEMBL ID

SCHEMBL831723

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

VOGBKCAANIAXCI-UHFFFAOYSA-N

1 reference

1 reference

VOGBKCAANIAXCI-UHFFFAOYSA-N

17 April 2021

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

Sitelinks

Wikipedia(1 entry)

eswiki Ácido acetilénico

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