Chem
J-GLOBAL ID:200907024412893642   Nikkaji number:J221.807K

Asticolorin A

アスチコロリンA
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: C33H30O7
Molecular formula furigana: C33-H30-O7
Molecular weight: 538.596
InChI: InChI=1S/C33H30O7/c1-13-7-18(34)26-20(9-13)38-22-11-23-24(16(4)25(22)26)17-6-15(3)12-32(5)28-27-19(35)8-14(2)10-21(27)39-29(28)31(36)33(37,40-23)30(17)32/h6-11,17,30-31,34-37H,12H2,1-5H3/t17-,30+,31-,32+,33-/m0/s1
InChI key: JCRLYBYVQJKZSH-FZDZXSKASA-N
SMILES: CC1=C[C@@H]2[C@@H]3[C@](C)(C1)c1c(oc4cc(C)cc(O)c14)[C@H](O)[C@@]3(O)Oc1cc3oc4cc(C)cc(O)c4c3c(C)c21
Systematic name  (3):
  • [3aS,(-)]-3,3a,9,9a,17bβ,17cβ-ヘキサヒドロ-2,3aβ,6,14,17-ペンタメチルベンゾ[kl]ビスベンゾフロ[3,2-b:2′,3′-i]キサンテン-4,9α,9aα,16-テトラオール
  • (1R,16S,17S,27S,31R)-3,8,22,27,29-ペンタメチル-11,15,19-トリオキサオクタシクロ[14.14.1.02,14.04,12.05,10.018,26.020,25.027,31]ヘントリアコンタ-2,4(12),5(10),6,8,13,18(26),20,22,24,29-ウンデカエン-6,16,17,24-テトラオール
  • (1R,16S,17S,27S,31R)-3,8,22,27,29-pentamethyl-11,15,19-trioxaoctacyclo[14.14.1.02,14.04,12.05,10.018,26.020,25.027,31]hentriaconta-2,4(12),5(10),6,8,13,18(26),20,22,24,29-undecaene-6,16,17,24-tetrol
Other name (3):
  • Asticolorin A
  • アスチコロリンA
  • [3aS,(-)]-3,3a,9,9a,17bβ,17cβ-Hexahydro-2,3aβ,6,14,17-pentamethylbenzo[kl]bisbenzofuro[3,2-b:2′,3′-i]xanthene-4,9α,9aα,16-tetrol
CAS registry number: 93376-70-6
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