Chem
J-GLOBAL ID:200907002119492559
Nikkaji number:J395.865E
(1aR,8aR,9R)-1aβ,2,2a,6,6aα,8b-Hexahydro-2aα-hydroxy-9-(1-hydroxy-1-methylethyl)-8bα-methyl-3α,6α-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione
(1R,3R,5R,8S,9R,12S,13R,14R)-1-ヒドロキシ-14-(2-ヒドロキシプロパン-2-イル)-13-メチル-4,7,10-トリオキサペンタシクロ[6.4.1.19,12 .03,5 .05,13 ]テトラデカン-6,11-ジオン
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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:
C15 H18 O7
Molecular formula furigana:
C15-H18-O7
Molecular weight:
310.302
InChI:
InChI=1S/C15H18O7/c1-12(2,18)6-7-10(16)20-8(6)9-13(3)14(7,19)4-5-15(13,22-5)11(17)21-9/h5-9,18-19H,4H2,1-3H3/t5-,6-,7-,8-,9-,13-,14-,15-/m1/s1
InChI key:
RYEFFICCPKWYML-RGBVSASTSA-N
SMILES:
CC(C)(O)[C@H]1[C@H]2OC(=O)[C@@H]1[C@]1(O)C[C@H]3O[C@]43C(=O)O[C@H]2[C@]14C
Systematic name (3):
(1aR,8aR,9R)-1aβ,2,2a,6,6aα,8b-ヘキサヒドロ-2aα-ヒドロキシ-9-(1-ヒドロキシ-1-メチルエチル)-8bα-メチル-3α,6α-メタノ-8H-1,5,7-トリオキサシクロペンタ[ij]シクロプロパ[a]アズレン-4,8(3H)-ジオン
(1R,3R,5R,8S,9R,12S,13R,14R)-1-ヒドロキシ-14-(2-ヒドロキシプロパン-2-イル)-13-メチル-4,7,10-トリオキサペンタシクロ[6.4.1.19,12 .03,5 .05,13 ]テトラデカン-6,11-ジオン
(1R,3R,5R,8S,9R,12S,13R,14R)-1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.19,12 .03,5 .05,13 ]tetradecane-6,11-dione
Other name (1):
(1aR,8aR,9R)-1aβ,2,2a,6,6aα,8b-Hexahydro-2aα-hydroxy-9-(1-hydroxy-1-methylethyl)-8bα-methyl-3α,6α-methano-8H-1,5,7-trioxacyclopenta[ij]cycloprop[a]azulene-4,8(3H)-dione
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