Chem
J-GLOBAL ID：200907081364810040   Nikkaji number：J1.529.737I

Parvifolol A

パルビホロール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： C28H22O7
Molecular formula furigana： C28-H22-O7
Molecular weight： 470.477
InChI： InChI=1S/C28H22O7/c29-15-3-1-13(2-4-15)28-27-21-10-19(33)11-22(34)25(21)24(14-7-17(31)9-18(32)8-14)26(27)20-6-5-16(30)12-23(20)35-28/h1-12,24,26-34H/t24-,26-,27-,28+/m1/s1
InChI key： HHCRXJSIODUTQN-SATIQFTFSA-N
SMILES： Oc1ccc(cc1)[C@@H]1Oc2cc(O)ccc2[C@H]2[C@H]1c1cc(O)cc(O)c1[C@H]2c1cc(O)cc(O)c1
Systematic name  (3)：
  • (6R)-6β-(4-ヒドロキシフェニル)-11β-(3,5-ジヒドロキシフェニル)-6,6aβ,11,11aα-テトラヒドロベンゾ[b]インデノ[2,1-d]ピラン-3,8,10-トリオール
  • (1R,9R,10S,17R)-17-(3,5-ジヒドロキシフェニル)-9-(4-ヒドロキシフェニル)-8-オキサテトラシクロ[8.7.0.02,7.011,16]ヘプタデカ-2,4,6,11,13,15-ヘキサエン-5,13,15-トリオール
  • (1R,9R,10S,17R)-17-(3,5-dihydroxyphenyl)-9-(4-hydroxyphenyl)-8-oxatetracyclo[8.7.0.02,7.011,16]heptadeca-2,4,6,11,13,15-hexaene-5,13,15-triol
Other name (3)：
  • (6R)-6β-(4-Hydroxyphenyl)-11β-(3,5-dihydroxyphenyl)-6,6aβ,11,11aα-tetrahydrobenzo[b]indeno[2,1-d]pyran-3,8,10-triol
  • パルビホロールA
  • Parvifolol A
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