Chem
J-GLOBAL ID:200907058393857763
Nikkaji number:J817.944A
Byzantionoside A
ビザンチオノシドA
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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:
C19 H30 O7
Molecular formula furigana:
C19-H30-O7
Molecular weight:
370.442
InChI:
InChI=1S/C19H30O7/c1-10-7-12(8-19(3,4)13(10)6-5-11(2)21)25-18-17(24)16(23)15(22)14(9-20)26-18/h5-7,12-18,20,22-24H,8-9H2,1-4H3/b6-5+/t12-,13-,14+,15+,16-,17+,18+/m0/s1
InChI key:
DSYFGNYNOFNAON-BHRLKQCISA-N
SMILES:
CC(=O)/C=C/[C@H]1C(=C[C@@H](CC1(C)C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C
Systematic name (3):
(E)-4-[(1R)-4α-(β-D-グルコピラノシルオキシ)-2,6,6-トリメチル-2-シクロヘキセン-1β-イル]-3-ブテン-2-オン
(3E)-4-[(1R,4R)-2,6,6-トリメチル-4-{[(2R,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}シクロヘキサ-2-エン-1-イル]ブタ-3-エン-2-オン
(3E)-4-[(1R,4R)-2,6,6-trimethyl-4-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}cyclohex-2-en-1-yl]but-3-en-2-one
Other name (3):
ビザンチオノシドA
Byzantionoside A
(E)-4-[(1R)-4α-(β-D-Glucopyranosyloxy)-2,6,6-trimethyl-2-cyclohexen-1β-yl]-3-buten-2-one
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