Chem
J-GLOBAL ID:200907017883999312
Nikkaji number:J156.605I
β,β-Dimethylacrylshikonin
β,β-ジメチルアクリルシコニン
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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:
C21 H22 O6
Molecular formula furigana:
C21-H22-O6
Molecular weight:
370.401
InChI:
InChI=1S/C21H22O6/c1-11(2)5-8-17(27-18(25)9-12(3)4)13-10-16(24)19-14(22)6-7-15(23)20(19)21(13)26/h5-7,9-10,17,22-23H,8H2,1-4H3/t17-/m1/s1
InChI key:
BATBOVZTQBLKIL-QGZVFWFLSA-N
SMILES:
CC(=CC[C@@H](OC(=O)C=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O)C
Systematic name (5):
3-メチル-2-ブテン酸(R)-1-[(1,4-ジオキソ-5,8-ジヒドロキシ-1,4-ジヒドロナフタレン)-2-イル]-4-メチル-3-ペンテニル
3-メチル-2-ブテン酸(R)-1-(1,4-ジヒドロ-5,8-ジヒドロキシ-1,4-ジオキソナフタレン-2-イル)-4-メチル-3-ペンテニル
3-メチル-2-ブテン酸(R)-1-(1,4-ジオキソ-5,8-ジヒドロキシ-1,4-ジヒドロナフタレン-2-イル)-4-メチル-3-ペンテニル
(1R)-1-(5,8-ジヒドロキシ-1,4-ジオキソ-1,4-ジヒドロナフタレン-2-イル)-4-メチルペンタ-3-エン-1-イル 3-メチルブタ-2-エノアート
(1R)-1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-4-methylpent-3-en-1-yl 3-methylbut-2-enoate
Other name (10):
セネシオイルシコニン
Senecioylshikonin
3-Methyl-2-butenoic acid (R)-1-(1,4-dihydro-5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methyl-3-pentenyl ester
β,β-ジメチルアクリルシコニン
β,β-Dimethylacrylshikonin
Dmask
ドマスク
(+)-3-Methyl-2-butenoic acid 1-(1,4-dihydro-5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)-4-methyl-3-pentenyl ester
(+)-3-メチル-2-ブテン酸1-(1,4-ジヒドロ-5,8-ジヒドロキシ-1,4-ジオキソナフタレン-2-イル)-4-メチル-3-ペンテニル
3-Methyl-2-butenoic acid (R)-1-(1,4-dioxo-5,8-dihydroxy-1,4-dihydronaphthalene-2-yl)-4-methyl-3-pentenyl ester
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CAS registry number:
24502-79-2
Regulation number (1):
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