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(Q105178326)
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English
C.I. Natural Red 20
group of stereoisomers with the chemical formula C₁₆H₁₆O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
2,6-dimethyloctane monoterpenoid
1 reference
inferred from
2,6-dimethyloctane monoterpenoid
biogenic naphthochinone
1 reference
inferred from
biogenic naphthochinone
mass
288.099773612
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₆O₅
0 references
canonical SMILES
O=C1C=C(C(=O)C=2C(O)=CC=C(O)C12)C(O)CC=C(C)C
0 references
found in taxon
Boraginaceae
1 reference
stated in
Shikonin exerts anti-inflammatory effects in a murine model of lipopolysaccharide-induced acute lung injury by inhibiting the nuclear factor-kappaB signaling pathway
Arnebia guttata
1 reference
stated in
Antimicrobial activities of naphthazarins from Arnebia euchroma
Lithospermum erythrorhizon
5 references
stated in
Naphthoquinones ofLithospermum erythrorhizon
stated in
Physical stability of shikonin derivatives from the roots of Lithospermum erythrorhizon cultivated in Korea.
stated in
Tigloylshikonin, a new minor Shikonin derivative, from the roots and the commercial root extract of lithospermum erythrorhizon
stated in
Shikonin, an ingredient of Lithospermum erythrorhizon, down-regulates the expression of steroid sulfatase genes in breast cancer cells
stated in
Regulation of shikonin production by glutamine in Lithospermum erythrorhizon cell cultures
Lithospermum officinale
1 reference
stated in
Geranylpyrophosphate synthase from cell cultures of Lithospermum erythrorhizon
Arnebia decumbens
1 reference
stated in
Shikonin Derivatives, Part VI. Chemical Investigations of Arnebia decumbens
Identifiers
InChI
InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3
0 references
InChIKey
NEZONWMXZKDMKF-UHFFFAOYSA-N
0 references
PubChem CID
5208
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
NEZONWMXZKDMKF-UHFFFAOYSA-N
ChEBI ID
174748
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C16H16O5/c1-8(2)3-4-10(17)9-7-13(20)14-11(18)5-6-12(19)15(14)16(9)21/h3,5-7,10,17-19H,4H2,1-2H3
UniChem compound ID
22739265
1 reference
stated in
UniChem
NMRShiftDB structure ID
20167676
1 reference
matched by identifier from
InChIKey
InChIKey
NEZONWMXZKDMKF-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0030579
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
NEZONWMXZKDMKF-UHFFFAOYSA-N
Probes And Drugs ID
PD038819
0 references
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