Chem
J-GLOBAL ID:201107053067888558
Nikkaji number:J2.945.621F
Jiadifenone
ジアジフェノン
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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:
C13 H16 O5
Molecular formula furigana:
C13-H16-O5
Molecular weight:
252.266
InChI:
InChI=1S/C13H16O5/c1-6-7-3-10(15)13(17)11(16)18-5-12(13,2)8(7)4-9(6)14/h8,10,15,17H,3-5H2,1-2H3/t8-,10+,12-,13+/m0/s1
InChI key:
GQOIWZICLSNVJT-YPWHJJHSSA-N
SMILES:
CC1=C2C[C@@H](O)[C@@]3(O)C(=O)OC[C@@]3(C)[C@H]2CC1=O
Systematic name (4):
(3aR)-3aβ,4α-ジヒドロキシ-6,8bβ-ジメチル-4,5,8aβ,8b-テトラヒドロ-1H-インデノ[4,5-c]フラン-3,7(3aH,8H)-ジオン
3aβ,4α-ジヒドロキシ-6α,8bβ-ジメチル-1,4,5,8,8aβ,8b-ヘキサヒドロ-3aH-インデノ[4,5-c]フラン-3,7-ジオン
(3aR,4R,8aS,8bR)-3a,4-ジヒドロキシ-6,8b-ジメチル-1H,3H,3aH,4H,5H,7H,8H,8aH,8bH-インデノ[4,5-c]フラン-3,7-ジオン
(3aR,4R,8aS,8bR)-3a,4-dihydroxy-6,8b-dimethyl-1H,3H,3aH,4H,5H,7H,8H,8aH,8bH-indeno[4,5-c]furan-3,7-dione
Other name (4):
(3aR)-3aβ,4α-Dihydroxy-6,8bβ-dimethyl-4,5,8aβ,8b-tetrahydro-1H-indeno[4,5-c]furan-3,7(3aH,8H)-dione
3aβ,4α-Dihydroxy-6α,8bβ-dimethyl-1,4,5,8,8aβ,8b-hexahydro-3aH-indeno[4,5-c]furan-3,7-dione
ジアジフェノン
Jiadifenone
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