Chem
J-GLOBAL ID：200907023584171804   Nikkaji number：J704.254J

Cistanoside F

シスタノシドF
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： C21H28O13
Molecular formula furigana： C21-H28-O13
Molecular weight： 488.442
InChI： InChI=1S/C21H28O13/c1-9-16(29)17(30)18(31)21(32-9)34-20(14(27)8-23)19(13(26)7-22)33-15(28)5-3-10-2-4-11(24)12(25)6-10/h2-6,8-9,13-14,16-22,24-27,29-31H,7H2,1H3/b5-3+/t9-,13+,14-,16-,17+,18+,19+,20+,21-/m0/s1
InChI key： KARNWFDIYRKBOE-BHSPTIPFSA-N
SMILES： C[C@@H]1O[C@@H](O[C@H]([C@@H](O)C=O)[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)[C@H](O)CO)[C@H](O)[C@H](O)[C@H]1O
Systematic name  (3)：
  • 4-O-[(E)-3-(3,4-ジヒドロキシフェニル)プロペノイル]-3-O-(6-デオキシ-α-L-マンノピラノシル)-D-グルコース
  • (2R,3R,4R,5R)-1,2,5-トリヒドロキシ-6-オキソ-4-{[(2S,3R,4R,5R,6S)-3,4,5-トリヒドロキシ-6-メチルオキサン-2-イル]オキシ}ヘキサン-3-イル (2E)-3-(3,4-ジヒドロキシフェニル)プロパ-2-エノアート
  • (2R,3R,4R,5R)-1,2,5-trihydroxy-6-oxo-4-{[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}hexan-3-yl (2E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
Other name (3)：
  • シスタノシドF
  • Cistanoside F
  • 4-O-[(E)-3-(3,4-Dihydroxyphenyl)propenoyl]-3-O-(6-deoxy-α-L-mannopyranosyl)-D-glucose
CAS registry number： 97411-47-7
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