Chem
J-GLOBAL ID:200907055937986121
Nikkaji number:J733.838D
Acerogenin E
アセロゲニンE
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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 H20 O3
Molecular formula furigana:
C19-H20-O3
Molecular weight:
296.366
InChI:
InChI=1S/C19H20O3/c20-15-4-2-1-3-13-6-9-18(21)16(11-13)17-12-14(5-8-15)7-10-19(17)22/h6-7,9-12,21-22H,1-5,8H2
InChI key:
HJJZJFOFYZSPGU-UHFFFAOYSA-N
SMILES:
Oc1ccc2CCCCC(=O)CCc3ccc(O)c(c3)c1c2
Systematic name (4):
3,17-ジヒドロキシトリシクロ[12.3.1.12,6 ]ノナデカ-1(18),2,4,6(19),14,16-ヘキサエン-9-オン
12,15-ジヒドロキシトリシクロ[12.3.1.19,13 ]ノナデカン-1(18),9,11,13(19),14,16-ヘキサエン-4-オン
3,17-ジヒドロキシトリシクロ[12.3.1.12,6 ]ノナデカ-1(18),2(19),3,5,14,16-ヘキサエン-9-オン
3,17-dihydroxytricyclo[12.3.1.12,6 ]nonadeca-1(18),2(19),3,5,14,16-hexaen-9-one
Other name (4):
3,17-Dihydroxytricyclo[12.3.1.12,6 ]nonadeca-1(18),2,4,6(19),14,16-hexen-9-one
アセロゲニンE
Acerogenin E
12,15-Dihydroxytricyclo[12.3.1.19,13 ]nonadecane-1(18),9,11,13(19),14,16-hexene-4-one
CAS registry number:
52467-12-6
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