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Mutatochrome

CAT: 0013-GTR19256189-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19256189-02Size:50 mg
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Description
Mutatochrome (Citroxanthin) is a compound found in plants.
CAS Number
515-06-0
Field of Research
Immunology & Inflammation, Metabolism Research, Signal Transduction
Smiles
O1C (C=C2C1 (C) CCCC2 (C) C) C (=CC=CC (=CC=CC=C (C=CC=C (C=CC3=C (C) CCCC3 (C) C) C) C) C) C
Molecular Formula
C40H56O
Molecular Weight
552.872
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Citroxanthin

Mutatochrome is a xanthophyll.

CAS Number515-06-0
PubChem CID5281246
IUPAC Name4,4,7a-trimethyl-2-[(2E,4E,6E,8E,10E,12E,14E,16E)-6,11,15-trimethyl-17-(2,6,6-trimethylcyclohexen-1-yl)heptadeca-2,4,6,8,10,12,14,16-octaen-2-yl]-2,5,6,7-tetrahydro-1-benzofuran
Molecular FormulaC40H56O
Molecular Weight552.9
XLogP12.5
Topological Polar Surface Area9.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count9
Heavy Atom Count41
Formal Charge0
Complexity1260
SMILES
CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C2C=C3C(CCCC3(O2)C)(C)C)/C)/C
InChI
InChI=1S/C40H56O/c1-30(19-13-20-32(3)24-25-35-33(4)23-15-26-38(35,6)7)17-11-12-18-31(2)21-14-22-34(5)36-29-37-39(8,9)27-16-28-40(37,10)41-36/h11-14,17-22,24-25,29,36H,15-16,23,26-28H2,1-10H3/b12-11+,19-13+,21-14+,25-24+,30-17+,31-18+,32-20+,34-22+
InChIKey
GFPJSSAOISEBQL-FZKBJVJCSA-N
Chemical Structure
2D Structure
2D structure of Citroxanthin
CAS: 515-06-0
CID: 5281246
Formula: C40H56O
MW: 552.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight552.9
XLogP312.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count9
Exact Mass552.433116406
Monoisotopic Mass552.433116406
Topological Polar Surface Area9.2 Ų
Heavy Atom Count41
Formal Charge0
Complexity1260
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count8
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-N15440Mutatochrome

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