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calendic acid (Q2823246)

From Wikidata

chemical compound

8E,10E,12Z-octadecatrienoic acid
trans-8, trans-10, cis-12-octadecatrienoic acid
C18:3n-6,8,10
alpha-calendic acid
α-calendic acid
calendulic acid
(8E,10E,12Z)-octadecatrienoic acid

Language	Label	Description	Also known as
default for all languages	No label defined
English	calendic acid	chemical compound	8E,10E,12Z-octadecatrienoic acid trans-8, trans-10, cis-12-octadecatrienoic acid C18:3n-6,8,10 alpha-calendic acid α-calendic acid calendulic acid (8E,10E,12Z)-octadecatrienoic acid

Statements

type of chemical entity

0 references

8,10,12-octadecatrienoic acid

1 reference

based on heuristic

inferred from SMILES

chemical structure

Alpha-Calendic acid.svg
995 × 365; 10 KB

0 references

chemical formula

C₁₈H₃₀O₂

1 reference

language of work or name

Calendic acid (English)

9 October 2016

canonical SMILES

CCCCCC=CC=CC=CCCCCCCC(=O)O

1 reference

language of work or name

Calendic acid (English)

9 October 2016

isomeric SMILES

CCCCC/C=C\C=C\C=C\CCCCCCC(=O)O

1 reference

language of work or name

Calendic acid (English)

9 October 2016

Calendula officinalis

3 references

The biosynthesis of calendic acid, octadeca-(8E,10E, 12Z)-trienoic, acid, by developing marigold seeds: origins of (E,E,Z) and (Z,E,Z) conjugated triene acids in higher plants

CONJUGATED FATTY ACIDS OF TRAGOPOGON AND CALENDULA SEED OILS

Fatty acid composition of lipids in pot marigold (Calendula officinalis L.) seed genotypes.

278.22458 dalton

1 reference

language of work or name

Calendic acid (English)

9 October 2016

Identifiers

InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-11H,2-5,12-17H2,1H3,(H,19,20)/b7-6-,9-8+,11-10+

1 reference

language of work or name

Calendic acid (English)

9 October 2016

DQGMPXYVZZCNDQ-KBPWROHVSA-N

2 references

language of work or name

Calendic acid (English)

9 October 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

language of work or name

(8E,10E,12Z)-octadecatrienoic acid (English)

9 October 2016

DQGMPXYVZZCNDQ-KBPWROHVSA-N

CAS Common Chemistry

10 April 2021

https://commonchemistry.cas.org/detail?cas_rn=5204-87-5

1 reference

language of work or name

alpha-calendic acid (English)

9 October 2016

2 references

language of work or name

Calendic acid (English)

9 October 2016

matched by identifier from

DQGMPXYVZZCNDQ-KBPWROHVSA-N

Reaxys registry number

1726537

1 reference

language of work or name

(8E,10E,12Z)-octadecatrienoic acid (English)

9 October 2016

mapping relation type

2 references

language of work or name

(8E,10E,12Z)-octadecatrienoic acid (English)

9 October 2016

matched by identifier from

International Chemical Identifier

InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-11H,2-5,12-17H2,1H3,(H,19,20)/b7-6-,9-8+,11-10+

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

DQGMPXYVZZCNDQ-KBPWROHVSA-N

UniChem compound ID

1 reference

DSSTox substance ID

1 reference

matched by identifier from

DQGMPXYVZZCNDQ-KBPWROHVSA-N

DSSTOX compound identifier

DTXCID801326796

0 references

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

DQGMPXYVZZCNDQ-KBPWROHVSA-N

1 reference

matched by identifier from

DQGMPXYVZZCNDQ-KBPWROHVSA-N

Probes And Drugs ID

0 references

0 references

1 reference

Freebase Data Dumps

publication date

28 October 2013

Microsoft Academic ID (discontinued)

0 references

Sitelinks

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Wiktionary(0 entries)

Multilingual sites(0 entries)

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