Chem
J-GLOBAL ID:200907086888238133
Nikkaji number:J1.186.446E
Didymocalyxin B
ジジモカリキシン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:
C28 H22 O7
Molecular formula furigana:
C28-H22-O7
Molecular weight:
470.477
InChI:
InChI=1S/C28H22O7/c1-33-26-23-21(19(29)15-13-17-9-5-3-6-10-17)28(32)35-25(23)22(24(31)27(26)34-2)20(30)16-14-18-11-7-4-8-12-18/h3-16,29,31H,1-2H3/b15-13+,16-14+,21-19+
InChI key:
SYJASFPLLHXQRX-VZZMMMTHSA-N
SMILES:
COc1c2/C(=C(\O)/C=C/c3ccccc3)/C(=O)Oc2c(C(=O)/C=C/c2ccccc2)c(O)c1OC
Systematic name (3):
3-[(αE)-α-ヒドロキシ-trans-シンナミリデン]-4,5-ジメトキシ-6-ヒドロキシ-7-trans-シンナモイル-2,3-ジヒドロベンゾフラン-2-オン
(3E)-6-ヒドロキシ-3-[(2E)-1-ヒドロキシ-3-フェニルプロパ-2-エン-1-イリデン]-4,5-ジメトキシ-7-[(2E)-3-フェニルプロパ-2-エノイル]-2,3-ジヒドロ-1-ベンゾフラン-2-オン
(3E)-6-hydroxy-3-[(2E)-1-hydroxy-3-phenylprop-2-en-1-ylidene]-4,5-dimethoxy-7-[(2E)-3-phenylprop-2-enoyl]-2,3-dihydro-1-benzofuran-2-one
Other name (3):
3-[(αE)-α-Hydroxy-trans-cinnamylidene]-4,5-dimethoxy-6-hydroxy-7-trans-cinnamoyl-2,3-dihydrobenzofuran-2-one
ジジモカリキシンB
Didymocalyxin B
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