Chem
J-GLOBAL ID：200907061328923008
Nikkaji number：J2.032.102D
(2aS,4aβ,7aβ,7bβ)-4β-(4-Hydroxy-trans-cinnamoyloxy)-6α-methoxyoctahydro-2H-1,7-dioxacyclopenta[cd]indene-2aβ-ol
(2aS,4aβ,7aβ,7bβ)-4β-(4-ヒドロキシ-trans-シンナモイルオキシ)-6α-メトキシオクタヒドロ-2H-1,7-ジオキサシクロペンタ[cd]インデン-2aβ-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： C19H22O7
Molecular formula furigana： C19-H22-O7
Molecular weight： 362.378
InChI：
InChI=1S/C19H22O7/c1-23-16-8-13-14(9-19(22)10-24-18(26-16)17(13)19)25-15(21)7-4-11-2-5-12(20)6-3-11/h2-7,13-14,16-18,20,22H,8-10H2,1H3/b7-4+/t13-,14+,16+,17+,18-,19+/m0/s1
InChI key：
IAAABTPANVNWIO-GDXTXENQSA-N
SMILES：
CO[C@H]1C[C@H]2[C@@H](C[C@@]3(O)CO[C@@H](O1)[C@@H]23)OC(=O)/C=C/c1ccc(O)cc1
Systematic name (3)：
- (2aS,4aβ,7aβ,7bβ)-4β-(4-ヒドロキシ-trans-シンナモイルオキシ)-6α-メトキシオクタヒドロ-2H-1,7-ジオキサシクロペンタ[cd]インデン-2aβ-オール
- (1S,4S,6R,7R,9R,11S)-4-ヒドロキシ-9-メトキシ-2,10-ジオキサトリシクロ[5.3.1.04,11]ウンデカン-6-イル (2E)-3-(4-ヒドロキシフェニル)プロパ-2-エノアート
- (1S,4S,6R,7R,9R,11S)-4-hydroxy-9-methoxy-2,10-dioxatricyclo[5.3.1.04,11]undecan-6-yl (2E)-3-(4-hydroxyphenyl)prop-2-enoate
- (2aS,4aβ,7aβ,7bβ)-4β-(4-Hydroxy-trans-cinnamoyloxy)-6α-methoxyoctahydro-2H-1,7-dioxacyclopenta[cd]indene-2aβ-ol
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