The Prescription of Drugs Ontology

Last uploaded: September 4, 2020
Preferred Name

carminic acid
Synonyms

Cochineal tincture

Coccinellin

C.I. Natural Red 4

Sun Red No. 1

Coccus cacti extract

Carmine red

Cochineal extract

Natural red 4

C.I. 75470

Carmine

Cochineal

Sanred 1

Sun Red 1

(1S)-1,5-anhydro-1-(7-carboxy-1,3,4,6-tetrahydroxy-8-methyl-9,10-dioxo-9,10-dihydroanthracen-2-yl)-D-glucitol

Definitions

A tetrahydroxyanthraquinone that is that is 1,3,4,6-tetrahydroxy-9,10-anthraquinone substituted by a methyl group at position 8, a carboxy group at position 7 and a 1,5-anhydro-D-glucitol moiety at position 2 via a C-glycosidic linkage. It is a natural dye isolated from several insects such as Dactylopius coccus.

ID

http://purl.obolibrary.org/obo/CHEBI_78310

alternative term

Cochineal tincture

Coccinellin

C.I. Natural Red 4

Sun Red No. 1

Coccus cacti extract

Carmine red

Cochineal extract

Natural red 4

C.I. 75470

Carmine

Cochineal

Sanred 1

Sun Red 1

(1S)-1,5-anhydro-1-(7-carboxy-1,3,4,6-tetrahydroxy-8-methyl-9,10-dioxo-9,10-dihydroanthracen-2-yl)-D-glucitol

bearer_of

http://purl.obolibrary.org/obo/CHEBI_75767

http://purl.obolibrary.org/obo/CHEBI_77178

charge

0

database_cross_reference

KEGG:C11254

Wikipedia:Carminic_acid

Reaxys:1414932

PMID:24415463

PMID:24731378

PMID:29551461

PMID:32319483

FooDB:FDB002568

PMID:24733592

CAS:1260-17-9

HMDB:HMDB0030658

formula

C22H20O13

has role

http://purl.obolibrary.org/obo/CHEBI_75767

http://purl.obolibrary.org/obo/CHEBI_77178

has_alternative_id

CHEBI:3422

has_exact_synonym

(1S)-1,5-anhydro-1-(7-carboxy-1,3,4,6-tetrahydroxy-8-methyl-9,10-dioxo-9,10-dihydroanthracen-2-yl)-D-glucitol

has_obo_namespace

chebi_ontology

has_related_synonym

Cochineal tincture

Coccinellin

C.I. Natural Red 4

Sun Red No. 1

Coccus cacti extract

Carmine red

Cochineal extract

Natural red 4

C.I. 75470

Carmine

Cochineal

Sanred 1

Sun Red 1

id

CHEBI:78310

in_subset

http://purl.obolibrary.org/obo/chebi#3_STAR

inchi

InChI=1S/C22H20O13/c1-4-8-5(2-6(24)9(4)22(33)34)13(25)10-11(15(8)27)16(28)12(18(30)17(10)29)21-20(32)19(31)14(26)7(3-23)35-21/h2,7,14,19-21,23-24,26,28-32H,3H2,1H3,(H,33,34)/t7-,14-,19+,20-,21+/m1/s1

inchikey

DGQLVPJVXFOQEV-JNVSTXMASA-N

is conjugate acid of

http://purl.obolibrary.org/obo/CHEBI_149531

label

carminic acid

mass

492.389

monoisotopicmass

492.09039

notation

CHEBI:78310

prefLabel

carminic acid

smiles

C=1(C(=C2C(C3=C(C=C(O)C(C(O)=O)=C3C)C(C2=C(O)C1O)=O)=O)O)[C@@H]4O[C@@H]([C@H]([C@@H]([C@H]4O)O)O)CO

textual definition

A tetrahydroxyanthraquinone that is that is 1,3,4,6-tetrahydroxy-9,10-anthraquinone substituted by a methyl group at position 8, a carboxy group at position 7 and a 1,5-anhydro-D-glucitol moiety at position 2 via a C-glycosidic linkage. It is a natural dye isolated from several insects such as Dactylopius coccus.

subClassOf

http://purl.obolibrary.org/obo/CHEBI_20857

http://purl.obolibrary.org/obo/CHEBI_37496

http://purl.obolibrary.org/obo/CHEBI_25384

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