Products for Research Use Only
RegisterLogin

Carmine

CAT: 0063-10807308-02Size: 5 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0063-10807308-02Size:5 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
1390-65-4

Chemical Information

Carmine

Coloring matter from the insect Coccus cacti L. It is used in foods, pharmaceuticals, toiletries, etc., as a dye, and also has use as a microscopic stain and biological marker.

CAS Number1390-65-4
PubChem CID14749
IUPAC Name3,5,6,8-tetrahydroxy-1-methyl-9,10-dioxo-7-[(2R,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]anthracene-2-carboxylic acid
Molecular FormulaC22H20O13
Molecular Weight492.4
XLogP0.5
Topological Polar Surface Area243
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count13
Rotatable Bond Count3
Heavy Atom Count35
Formal Charge0
Complexity864
SMILES
CC1=C2C(=CC(=C1C(=O)O)O)C(=O)C3=C(C2=O)C(=C(C(=C3O)O)[C@@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O
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-NGOCYOHBSA-N
Chemical Structure
2D Structure
2D structure of Carmine
CAS: 1390-65-4
CID: 14749
Formula: C22H20O13
MW: 492.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight492.4
XLogP30.5
Hydrogen Bond Donor Count9
Hydrogen Bond Acceptor Count13
Rotatable Bond Count3
Exact Mass492.09039069
Monoisotopic Mass492.09039069
Topological Polar Surface Area243 Ų
Heavy Atom Count35
Formal Charge0
Complexity864
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
90028022D- (+) -Carvone
90028022-50gD- (+) -Carvone

Alternative Products

CatalogName
TN1467Carmine
HY-W040226Indigo carmine
HY-127154Carmine (lithium)
40140047-1Aceto Carmine

Popular Products