Chem
J-GLOBAL ID:201407047045651173
Nikkaji number:J3.277.386I
12,13,19-Trihydroxymangostin
12,13,19-トリヒドロキシマンゴスチン
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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:
C24 H28 O9
Molecular formula furigana:
C24-H28-O9
Molecular weight:
460.479
InChI:
InChI=1S/C24H28O9/c1-11(10-25)5-6-12-19-16(9-15(27)23(12)32-4)33-17-8-14(26)13(7-18(28)24(2,3)31)21(29)20(17)22(19)30/h5,8-9,18,25-29,31H,6-7,10H2,1-4H3/b11-5+
InChI key:
KXWWBRHUKRPZMD-VZUCSPMQSA-N
SMILES:
COc1c(O)cc2oc3cc(O)c(CC(O)C(C)(C)O)c(O)c3c(=O)c2c1C/C=C(\C)/CO
Systematic name (4):
2-(2,3-ジヒドロキシ-3-メチルブチル)-1,3,6-トリヒドロキシ-8-[(E)-4-ヒドロキシ-3-メチル-2-ブテニル]-7-メトキシ-9H-キサンテン-9-オン
1,3,6-トリヒドロキシ-2-(2,3-ジヒドロキシ-3-メチルブチル)-8-[(E)-3-メチル-4-ヒドロキシ-2-ブテニル]-7-メトキシ-9H-キサンテン-9-オン
2-(2,3-ジヒドロキシ-3-メチルブチル)-1,3,6-トリヒドロキシ-8-[(2E)-4-ヒドロキシ-3-メチルブタ-2-エン-1-イル]-7-メトキシ-9H-キサンテン-9-オン
2-(2,3-dihydroxy-3-methylbutyl)-1,3,6-trihydroxy-8-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-7-methoxy-9H-xanthen-9-one
Other name (4):
2-(2,3-Dihydroxy-3-methylbutyl)-1,3,6-trihydroxy-8-[(E)-4-hydroxy-3-methyl-2-butenyl]-7-methoxy-9H-xanthene-9-one
12,13,19-トリヒドロキシマンゴスチン
12,13,19-Trihydroxymangostin
1,3,6-Trihydroxy-2-(2,3-dihydroxy-3-methylbutyl)-8-[(E)-3-methyl-4-hydroxy-2-butenyl]-7-methoxy-9H-xanthene-9-one
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