Chem
J-GLOBAL ID：200907009868671979   Nikkaji number：J2.659.268B

(2R,2′S,3R)-2′-(α-L-Fucopyranosyloxy)-3′,4′-didehydro-1′,2′-dihydro-β,ψ-carotene-1′,2,3-triol

(2R,2′S,3R)-2′-(α-L-フコピラノシルオキシ)-3′,4′-ジデヒドロ-1′,2′-ジヒドロ-β,ψ-カロテン-1′,2,3-トリオール
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： C46H66O8
Molecular formula furigana： C46-H66-O8
Molecular weight： 747.026
InChI： InChI=1S/C46H66O8/c1-30(17-12-13-18-31(2)20-15-23-33(4)25-27-37-35(6)29-38(47)43(51)45(37,8)9)19-14-21-32(3)22-16-24-34(5)26-28-39(46(10,11)52)54-44-42(50)41(49)40(48)36(7)53-44/h12-28,36,38-44,47-52H,29H2,1-11H3/b13-12+,19-14+,20-15+,22-16+,27-25+,28-26?,30-17+,31-18+,32-21+,33-23+,34-24+/t36-,38+,39-,40+,41+,42-,43-,44-/m0/s1
InChI key： ZMWZXRUZZKSPPM-GXNAMGKQSA-N
SMILES： C[C@@H]1O[C@@H](O[C@@H](C=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)C[C@@H](O)[C@H](O)C2(C)C)/C)/C)/C)C(C)(C)O)[C@@H](O)[C@H](O)[C@@H]1O
Systematic name  (3)：
  • (2R,2′S,3R)-2′-(α-L-フコピラノシルオキシ)-3′,4′-ジデヒドロ-1′,2′-ジヒドロ-β,ψ-カロテン-1′,2,3-トリオール
  • (2S,3S,4R,5S,6S)-2-{[(3S,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-25-[(4R,5R)-4,5-ジヒドロキシ-2,6,6-トリメチルシクロヘキサ-1-エン-1-イル]-2-ヒドロキシ-2,6,10,14,19,23-ヘキサメチルペンタコサ-4,6,8,10,12,14,16,18,20,22,24-ウンデカエン-3-イル]オキシ}-6-メチルオキサン-3,4,5-トリオール
  • (2S,3S,4R,5S,6S)-2-{[(3S,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E)-25-[(4R,5R)-4,5-dihydroxy-2,6,6-trimethylcyclohex-1-en-1-yl]-2-hydroxy-2,6,10,14,19,23-hexamethylpentacosa-4,6,8,10,12,14,16,18,20,22,24-undecaen-3-yl]oxy}-6-methyloxane-3,4,5-triol
Other name (1)：
  • (2R,2′S,3R)-2′-(α-L-Fucopyranosyloxy)-3′,4′-didehydro-1′,2′-dihydro-β,ψ-carotene-1′,2,3-triol
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