Chem
J-GLOBAL ID：202207014785264456
Nikkaji number：J3.771.818A
(1S,12S)-7-(プロパ-1-エン-2-イル)-6,11,19-トリオキサペンタシクロ[10.8.0.02,10.05,9.013,18]イコサ-2(10),3,5(9),13,15,17-ヘキサエン-1,16-ジオール
(1S,12S)-7-(プロパ-1-エン-2-イル)-6,11,19-トリオキサペンタシクロ[10.8.0.02,10.05,9.013,18]イコサ-2(10),3,5(9),13,15,17-ヘキサエン-1,16-ジオール
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
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
Molecular formula： C20H18O5
Molecular formula furigana： C20-H18-O5
Molecular weight： 338.359
InChI：
InChI=1S/C20H18O5/c1-10(2)16-8-13-15(24-16)6-5-14-18(13)25-19-12-4-3-11(21)7-17(12)23-9-20(14,19)22/h3-7,16,19,21-22H,1,8-9H2,2H3/t16?,19-,20+/m0/s1
InChI key：
HMRUPQQCXBPLCF-KHMGXFTDSA-N
SMILES：
CC(=C)C1Cc2c(O1)ccc1[C@@]3(COc4cc(O)ccc4[C@@H]3Oc21)O
Systematic name (2)：
- (1S,12S)-7-(プロパ-1-エン-2-イル)-6,11,19-トリオキサペンタシクロ[10.8.0.02,10.05,9.013,18]イコサ-2(10),3,5(9),13,15,17-ヘキサエン-1,16-ジオール
- (1S,12S)-7-(prop-1-en-2-yl)-6,11,19-trioxapentacyclo[10.8.0.02,10.05,9.013,18]icosa-2(10),3,5(9),13,15,17-hexaene-1,16-diol
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