Chem
J-GLOBAL ID：200907037628330388   Nikkaji number：J13.457K

Jacareubin

ジャカロイビン
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： C18H14O6
Molecular formula furigana： C18-H14-O6
Molecular weight： 326.304
InChI： InChI=1S/C18H14O6/c1-18(2)6-5-8-11(24-18)7-12-13(14(8)20)15(21)9-3-4-10(19)16(22)17(9)23-12/h3-7,19-20,22H,1-2H3
InChI key： UCLUVPCGXYTYEK-UHFFFAOYSA-N
SMILES： CC1(C)Oc2cc3oc4c(O)c(O)ccc4c(=O)c3c(O)c2C=C1
Systematic name  (4)：
  • 5,9,10-トリヒドロキシ-2,2-ジメチル-2H,6H-ピラノ[3,2-b]キサンテン-6-オン
  • 2,2-ジメチル-5,9,10-トリヒドロキシ-1,11-ジオキサ-1,2-ジヒドロナフタセン-6(11H)-オン
  • 5,9,10-トリヒドロキシ-2,2-ジメチル-2,6-ジヒドロ-1,11-ジオキサテトラセン-6-オン
  • 5,9,10-trihydroxy-2,2-dimethyl-2,6-dihydro-1,11-dioxatetracen-6-one
Other name (4)：
  • ジャカロイビン
  • Jacareubin
  • 5,9,10-Trihydroxy-2,2-dimethyl-2H,6H-pyrano[3,2-b]xanthen-6-one
  • 2,2-Dimethyl-5,9,10-trihydroxy-1,11-dioxa-1,2-dihydronaphthacene-6(11H)-one
CAS registry number： 3811-29-8
KEGG COMPOUND： C10074
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