Product Code

TRC-A638240

CAS Number

68831-78-7

Product Format

Neat

Molecular Formula

C40 H56 O3

Molecular Weight

584.87

Product Categories

TRC, Stains & dyes

Product Type

Contaminant

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Antheraxanthin

CAS Number

68831-78-7

Molecular Formula

C40 H56 O3

Molecular Weight

584.87

Accurate Mass

584.42

SMILES

O[C@H]1CC(C)(C)C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)\C=C\[C@@]2(O3)[C@@]3(C)C[C@@H](O)CC2(C)C)=C(C)C1

InChI

InChI=1S/C40H56O3/c1-29(17-13-19-31(3)21-22-36-33(5)25-34(41)26-37(36,6)7)15-11-12-16-30(2)18-14-20-32(4)23-24-40-38(8,9)27-35(42)28-39(40,10)43-40/h11-24,34-35,41-42H,25-28H2,1-10H3/b12-11+,17-13+,18-14+,22-21+,24-23+,29-15+,30-16+,31-19+,32-20-/t34-,35+,39-,40+/m1/s1

IUPAC

(1R,3S,6S)-6-((1E,3Z,5E,7E,9E,11E,13E,15E,17E)-18-((R)-4-Hdroxy-2,6,6-trimethylcyclohex-1-en-1-yl)-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl)-1,5,5-trimethyl-7-oxabicyclo[4.1.0]heptan-3-ol

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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