alpha-carotene

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 43
Total Number of Articles : 40
PubChem 6419725
Molecular Formula

C40H56

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)/C=C/[C@H]2C(=CCCC2(C)C)C)/C)/C

InChI

InChI=1S/C40H56/c1-31(19-13-21-33(3)25-27-37-35(5)23-15-29-39(37,7)8)17-11-12-18-32(2)20-14-22-34(4)26-28-38-36(6)24-16-30-40(38,9)10/h11-14,17-23,25-28,37H,15-16,24,29-30H2,1-10H3/b12-11+,19-13+,20-14+,27-25+,28-26+,31-17+,32-18+,33-21+,34-22+/t37-/m0/s1

synonyms
  • ALPHA-CAROTENE
  • 7488-99-5
  • (+)-alpha-Carotene
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Properties
Property Value
MW 536.9 g/mol
HBD 0
HBA 0
Rotatable Bond Count 10
Exact Mass 536.438201786 g/mol
Monoisotopic Mass 536.438201786 g/mol
Heavy Atom Count 40
Isotope Atom Count 0
Atom Stereo Count 1
Covalent Unit Count 1
Complexity 1200
xlogp 13.6
Topological Polar Surface Area 0