Chem
J-GLOBAL ID:200907053613863040
Nikkaji number:J2.456.603J
Hanagokenol A
ハナゴケノール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:
C20 H26 O3
Molecular formula furigana:
C20-H26-O3
Molecular weight:
314.425
InChI:
InChI=1S/C20H26O3/c1-11(2)12-8-13-14(9-15(12)21)20(4)7-5-6-19(3)10-23-17(16(13)22)18(19)20/h8-9,11,17-18,21H,5-7,10H2,1-4H3/t17-,18-,19-,20+/m0/s1
InChI key:
CDWJWTTWDBMXNW-LWYYNNOASA-N
SMILES:
CC(C)c1cc2C(=O)[C@@H]3OC[C@]4(C)CCC[C@@](C)([C@@H]34)c2cc1O
Systematic name (4):
12-ヒドロキシ-6α,18-エポキシアビエタ-8(14),9(11),12-トリエン-7-オン
12-ヒドロキシ-6α,18-エポキシアビエタ-8,11,13-トリエン-7-オン
(1S,9R,12R,16R)-4-ヒドロキシ-1,12-ジメチル-5-(プロパン-2-イル)-10-オキサテトラシクロ[7.6.1.02,7 .012,16 ]ヘキサデカ-2(7),3,5-トリエン-8-オン
(1S,9R,12R,16R)-4-hydroxy-1,12-dimethyl-5-(propan-2-yl)-10-oxatetracyclo[7.6.1.02,7 .012,16 ]hexadeca-2(7),3,5-trien-8-one
Other name (4):
12-Hydroxy-6α,18-epoxyabieta-8(14),9(11),12-triene-7-one
12-Hydroxy-6α,18-epoxyabieta-8,11,13-triene-7-one
ハナゴケノールA
Hanagokenol A
Thsaurus map:
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