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Curcumin-d6

CAT: 1596-AR-C03723-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAT#:1596-AR-C03723-01Size:10 Units
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1335198-02-1
Synonyms
(1E,6E) -1,7-Bis (4-hydroxy-3-methoxyphenyl) -1,6-heptadiene-3,5-dione-d6; (E, E) -1,7-Bis (4-hydroxy-3-methoxyphenyl) -1,6-heptadiene-3,5-dione-d6; C Yellow 15-d6; C.I. 75300-d6; Curcuma-d6; Curcumine-d6; Diferuloylmethane-d6; Haidr-d6; Halad-d6; Haldar-d6; Ukon-d6
Molecular Formula
C21H14O6D6
Molecular Weight
374.43
API Name
Curcumin

Chemical Information

(1E,4Z,6E)-5-Hydroxy-1,7-bis[4-hydroxy-3-(methoxy-D3)phenyl]-1,4,6-heptatrien-3-one
CAS Number1335198-02-1
PubChem CID87401562
IUPAC Name(1E,4Z,6E)-5-hydroxy-1,7-bis[4-hydroxy-3-(trideuteriomethoxy)phenyl]hepta-1,4,6-trien-3-one
Molecular FormulaC21H20O6
Molecular Weight374.4
XLogP4
Topological Polar Surface Area96.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count27
Formal Charge0
Complexity567
SMILES
[2H]C([2H])([2H])OC1=C(C=CC(=C1)/C=C/C(=C/C(=O)/C=C/C2=CC(=C(C=C2)O)OC([2H])([2H])[2H])/O)O
InChI
InChI=1S/C21H20O6/c1-26-20-11-14(5-9-18(20)24)3-7-16(22)13-17(23)8-4-15-6-10-19(25)21(12-15)27-2/h3-13,22,24-25H,1-2H3/b7-3+,8-4+,16-13-/i1D3,2D3
InChIKey
ZIUSSTSXXLLKKK-JGJCSXQMSA-N
Chemical Structure
2D Structure
2D structure of (1E,4Z,6E)-5-Hydroxy-1,7-bis[4-hydroxy-3-(methoxy-D3)phenyl]-1,4,6-heptatrien-3-one
CAS: 1335198-02-1
CID: 87401562
Formula: C21H20O6
MW: 374.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight374.4
XLogP34
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass374.16364883
Monoisotopic Mass374.16364883
Topological Polar Surface Area96.2 Ų
Heavy Atom Count27
Formal Charge0
Complexity567
Isotope Atom Count6
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count3
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CS-T-86310Tetrahydro Curcumin-d6 (Mixture of Isomers)
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