Chem
J-GLOBAL ID:200907029090187692   Nikkaji number:J1.799.729G

Thermozeaxanthin-15

テルモゼアキサンチン-15
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: C61H94O8
Molecular formula furigana: C61-H94-O8
Molecular weight: 955.415
InChI: InChI=1S/C61H94O8/c1-43(2)26-20-18-16-14-13-15-17-19-21-33-55(63)67-42-54-56(64)57(65)58(66)59(69-54)68-51-39-49(8)53(61(11,12)41-51)37-35-47(6)32-25-30-45(4)28-23-22-27-44(3)29-24-31-46(5)34-36-52-48(7)38-50(62)40-60(52,9)10/h22-25,27-32,34-37,43,50-51,54,56-59,62,64-66H,13-21,26,33,38-42H2,1-12H3/b23-22+,29-24+,30-25+,36-34+,37-35+,44-27+,45-28+,46-31+,47-32+/t50-,51-,54-,56-,57+,58-,59-/m1/s1
InChI key: GUHDWRQBJQZYHJ-UXVUJNRNSA-N
SMILES: CC(C)CCCCCCCCCCCC(=O)OC[C@H]1O[C@@H](O[C@@H]2CC(=C(/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C3=C(C)C[C@@H](O)CC3(C)C)/C)/C)C(C)(C)C2)C)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3):
  • (3R,3′R)-3-[6-O-(13-メチル-1-オキソテトラデシル)-β-D-グルコピラノシルオキシ]-β,β-カロテン-3′-オール
  • [(2R,3S,4S,5R,6R)-3,4,5-トリヒドロキシ-6-{[(1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-ヒドロキシ-2,6,6-トリメチルシクロヘキサ-1-エン-1-イル]-3,7,12,16-テトラメチルオクタデカ-1,3,5,7,9,11,13,15,17-ノナエン-1-イル]-3,5,5-トリメチルシクロヘキサ-3-エン-1-イル]オキシ}オキサン-2-イル]メチル 13-メチルテトラデカノアート
  • [(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-{[(1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-3,7,12,16-tetramethyloctadeca-1,3,5,7,9,11,13,15,17-nonaen-1-yl]-3,5,5-trimethylcyclohex-3-en-1-yl]oxy}oxan-2-yl]methyl 13-methyltetradecanoate
Other name (3):
  • (3R,3′R)-3-[6-O-(13-Methyl-1-oxotetradecyl)-β-D-glucopyranosyloxy]-β,β-carotene-3′-ol
  • Thermozeaxanthin-15
  • テルモゼアキサンチン-15
KEGG COMPOUND: C15957
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