Structure Database (LMSD)
Common Name
9,9'-di-cis-zeta-carotene
Systematic Name
9-cis,9'-cis-7,8,7',8'-tetrahydro-psi,psi-carotene
Synonyms
- (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
- (9-cis,9'-cis)-7,7',8,8'-tetrahydro-psi,psi-carotene
- 9,9'-di-cis-zeta-carotene
3D model of 9,9'-di-cis-zeta-carotene
Please note: Where there are chiral atoms but the stereochemistry is undefined, the 3D model takes an arbitrary conformation
Classification
Category
Main Class
Sub Class
Reactions
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String Representations
InChiKey (Click to copy)
BIWLELKAFXRPDE-ZURBLSRNSA-N
InChi (Click to copy)
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-
SMILES (Click to copy)
C(=C/C=C/C=C(\C)/C=C/C=C(/C)\CC/C=C(\C)/CC/C=C(/C)\C)(/C)\C=C\C=C(\C)/CC/C=C(\C)/CC/C=C(/C)\C
Other Databases
Calculated Physicochemical Properties
Heavy Atoms
40
Rings
0
Aromatic Rings
0
Rotatable Bonds
18
Van der Waals Molecular Volume
671.52
Topological Polar Surface Area
0.00
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
0
logP
13.39
Molar Refractivity
185.76
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Created at
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Updated at
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