Chem
J-GLOBAL ID:200907033587252720
Nikkaji number:J2.727.351C
Makilactone O
マキラクトンO
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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:
C20 H24 O9 S
Molecular formula furigana:
C20-H24-O9-S
Molecular weight:
440.460
InChI:
InChI=1S/C20H24O9S/c1-17(24,6-30(4)25)15-20-7(5-8(21)26-15)18(2)11-9(14(20)29-20)28-16(23)19(11,3)12(22)10-13(18)27-10/h5,9-15,22,24H,6H2,1-4H3/t9-,10+,11+,12-,13+,14+,15+,17-,18+,19+,20-,30?/m0/s1
InChI key:
FTJAQTOZTDHBDI-VMBDWTJASA-N
SMILES:
CS(=O)C[C@](C)(O)[C@H]1OC(=O)C=C2[C@]31O[C@@H]3[C@H]1OC(=O)[C@]3(C)[C@H]1[C@]2(C)[C@@H]1O[C@@H]1[C@@H]3O
Systematic name (3):
(4R)-2-オキソ-4α-[(R)-1-ヒドロキシ-1-メチル-2-(メチルスルフィニル)エチル]-6β,8β-ジヒドロキシ-7,10aβ-ジメチル-4aα,5α:9β,10β-ジエポキシ-2,4a,5,6,6aα,7,8,9,10,10a-デカヒドロ-4H-ナフト[2,1-c]ピラン-7β-カルボン酸7,6-ラクトン
(1S,2R,4S,5R,10S,11S,13R,14R,15R,18R)-14-ヒドロキシ-5-[(2R)-2-ヒドロキシ-1-メタンスルフィニルプロパン-2-イル]-10,15-ジメチル-3,6,12,17-テトラオキサヘキサシクロ[8.7.1.02,4 .04,9 .011,13 .015,18 ]オクタデカ-8-エン-7,16-ジオン
(1S,2R,4S,5R,10S,11S,13R,14R,15R,18R)-14-hydroxy-5-[(2R)-2-hydroxy-1-methanesulfinylpropan-2-yl]-10,15-dimethyl-3,6,12,17-tetraoxahexacyclo[8.7.1.02,4 .04,9 .011,13 .015,18 ]octadec-8-ene-7,16-dione
Other name (3):
(4R)-2-Oxo-4α-[(R)-1-hydroxy-1-methyl-2-(methylsulfinyl)ethyl]-6β,8β-dihydroxy-7,10aβ-dimethyl-4aα,5α:9β,10β-diepoxy-2,4a,5,6,6aα,7,8,9,10,10a-decahydro-4H-naphtho[2,1-c]pyran-7β-carboxylic acid 7,6-lactone
マキラクトンO
Makilactone O
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