Chem
J-GLOBAL ID:200907090315716526
Nikkaji number:J2.771.063H
Zexbrevin B
ゼクスブレビンB
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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 H24 O7
Molecular formula furigana:
C19-H24-O7
Molecular weight:
364.394
InChI:
InChI=1S/C19H24O7/c1-9(2)16(21)25-13-7-18(5)14(20)8-19(23,26-18)10(3)6-12-15(13)11(4)17(22)24-12/h6,12-15,20,23H,1,4,7-8H2,2-3,5H3/b10-6-/t12-,13-,14+,15+,18-,19-/m1/s1
InChI key:
PKPVGZROZJWCTE-GIKWLFIVSA-N
SMILES:
CC(=C)C(=O)O[C@@H]1C[C@@]2(C)O[C@](O)(C[C@@H]2O)/C(=C\[C@H]2OC(=O)C(=C)[C@H]12)/C
Systematic name (3):
2-メチルプロペン酸(3aR,4R,6R,7S,9R,10Z,11aR)-2,3,3a,4,5,6,7,8,9,11a-デカヒドロ-7,9-ジヒドロキシ-6,10-ジメチル-3-メチレン-2-オキソ6,9-エポキシシクロデカ[b]フラン-4-イル
(1R,2Z,4R,8R,9R,11R,12S)-1,12-ジヒドロキシ-2,11-ジメチル-7-メチリデン-6-オキソ-5,14-ジオキサトリシクロ[9.2.1.04,8 ]テトラデカ-2-エン-9-イル 2-メチルプロパ-2-エノアート
(1R,2Z,4R,8R,9R,11R,12S)-1,12-dihydroxy-2,11-dimethyl-7-methylidene-6-oxo-5,14-dioxatricyclo[9.2.1.04,8 ]tetradec-2-en-9-yl 2-methylprop-2-enoate
Other name (3):
2-Methylpropenoic acid (3aR,4R,6R,7S,9R,10Z,11aR)-2,3,3a,4,5,6,7,8,9,11a-decahydro-7,9-dihydroxy-6,10-dimethyl-3-methylene-2-oxo 6,9-epoxycyclodeca[b]furan-4-yl ester
Zexbrevin B
ゼクスブレビンB
CAS registry number:
34302-19-7
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