CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)CCCC2(C)C)C(C)(C)CCC1
이름: β-carotene
SMILES: CC1=C(/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(C)/C=C/C2=C(C)CCCC2(C)C)C(C)(C)CCC1

Molecular Processing

Molecular formula
C40H56
Molecular weight
536.89
Exact mass
536.4382
XLogP
12.61
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
10
Heavy atoms
40
Rings
2
Aromatic rings
0
Saturated rings
0
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
0
Covalent units
1
Fraction Csp3
0.45
Molar refractivity
181.39

Supplementary Information

No supplementary data available

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