Chem
J-GLOBAL ID：200907010808332499   Nikkaji number：J1.923.778H

Erypoegin J

エリペギンJ
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： C26H28O5
Molecular formula furigana： C26-H28-O5
Molecular weight： 420.505
InChI： InChI=1S/C26H28O5/c1-15(2)6-7-17-20(28-5)9-8-19-23(17)30-24-18-12-16-10-11-25(3,4)31-21(16)13-22(18)29-14-26(19,24)27/h6,8-13,24,27H,7,14H2,1-5H3/t24-,26+/m0/s1
InChI key： KSXMILLEKYOTIP-AZGAKELHSA-N
SMILES： COc1ccc2c(O[C@H]3c4cc5C=CC(C)(C)Oc5cc4OC[C@@]23O)c1CC=C(C)C
Systematic name  (3)：
  • (7aS)-7a,12aα-ジヒドロ-10-メトキシ-3,3-ジメチル-11-(3-メチル-2-ブテニル)-3H,7H-ベンゾフロ[3,2-c]ピラノ[3,2-g][1]ベンゾピラン-7aα-オール
  • (2S,10S)-6-メトキシ-17,17-ジメチル-5-(3-メチルブタ-2-エン-1-イル)-3,12,16-トリオキサペンタシクロ[11.8.0.02,10.04,9.015,20]ヘンイコサ-1(21),4,6,8,13,15(20),18-ヘプタエン-10-オール
  • (2S,10S)-6-methoxy-17,17-dimethyl-5-(3-methylbut-2-en-1-yl)-3,12,16-trioxapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-1(21),4,6,8,13,15(20),18-heptaen-10-ol
Other name (3)：
  • (7aS)-7a,12aα-Dihydro-10-methoxy-3,3-dimethyl-11-(3-methyl-2-butenyl)-3H,7H-benzofuro[3,2-c]pyrano[3,2-g][1]benzopyran-7aα-ol
  • エリペギンJ
  • Erypoegin J
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