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ζ-Carotene

CAT: 0804-HY-W750690Size: 1 EachDry Ice: NoHazardous: No
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Description
ζ-Carotene, a carotenoid, is a key intermediate in the carotenoid pathway. Carotenoids are important biological active, and may regulate cellular differentiation, growth control, photooxidative protection, cell membrane stability, photosynthesis, vision process and nutrition[1].
CAS Number
72746-33-9
UNSPSC
12352211
Target
Drug Derivative
Related Pathways
Others
Field of Research
Others
Smiles
C/C(C)=C\CC/C(C)=C/CC/C(C)=C\C=C\C(C)=C\C=C\C=C(C)\C=C\C=C(C)/CC/C=C(C)/CC/C=C(C)\C
Molecular Formula
C40H60
Molecular Weight
540.90
References & Citations
[1]Zhang L, et al. Beneficial effect of ζ-carotene-like compounds on acute UVB irradiation by alleviating inflammation and regulating intestinal flora. Food Funct. 2023 Sep 19;14 (18) :8331-8350.
Shipping Conditions
Room temperature
Scientific Category
Natural Products
Clinical Information
No Development Reported

Chemical Information

Zeta-Carotene

9,9'-di-cis-zeta-carotene is a zeta-carotene.

CAS Number72746-33-9
PubChem CID6440490
IUPAC Name(6E,10Z,12E,14E,16E,18E,20E,22Z,26E)-2,6,10,14,19,23,27,31-octamethyldotriaconta-2,6,10,12,14,16,18,20,22,26,30-undecaene
Molecular FormulaC40H60
Molecular Weight540.9
XLogP15.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count18
Heavy Atom Count40
Formal Charge0
Complexity967
SMILES
CC(=CCC/C(=C/CC/C(=C\C=C\C(=C\C=C\C=C(\C=C\C=C(/CC/C=C(/CCC=C(C)C)\C)\C)/C)\C)/C)/C)C
InChI
InChI=1S/C40H60/c1-33(2)19-13-23-37(7)27-17-31-39(9)29-15-25-35(5)21-11-12-22-36(6)26-16-30-40(10)32-18-28-38(8)24-14-20-34(3)4/h11-12,15-16,19-22,25-30H,13-14,17-18,23-24,31-32H2,1-10H3/b12-11+,25-15+,26-16+,35-21+,36-22+,37-27+,38-28+,39-29-,40-30-
InChIKey
BIWLELKAFXRPDE-ZURBLSRNSA-N
Chemical Structure
2D Structure
2D structure of Zeta-Carotene
CAS: 72746-33-9
CID: 6440490
Formula: C40H60
MW: 540.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight540.9
XLogP315.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count0
Rotatable Bond Count18
Exact Mass540.469501914
Monoisotopic Mass540.469501914
Topological Polar Surface Area0 Ų
Heavy Atom Count40
Formal Charge0
Complexity967
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count9
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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