Chem
J-GLOBAL ID:200907027563653600   Nikkaji number:J1.872.102C

Carotane

カロタン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C40H78
Molecular formula furigana: C40-H78
Molecular weight: 559.064
InChI: InChI=1S/C40H78/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/h31-38H,11-30H2,1-10H3
InChI key: KINNMTBWIQCDPS-UHFFFAOYSA-N
SMILES: CC(CCCCC(C)CCCC(C)CCC1C(C)CCCC1(C)C)CCCC(C)CCC1C(C)CCCC1(C)C
Systematic name  (3):
  • ドコサヒドロ-β-カロテン
  • 1,1,3-トリメチル-2-[3,7,12,16-テトラメチル-18-(2,2,6-トリメチルシクロヘキシル)オクタデシル]シクロヘキサン
  • 1,1,3-trimethyl-2-[3,7,12,16-tetramethyl-18-(2,2,6-trimethylcyclohexyl)octadecyl]cyclohexane
Other name (5):
  • Docosahydro-β-carotene
  • カロタン
  • Carotane
  • ペルヒドロ-β-カロテン
  • Perhydro-β-carotene
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