Chem
J-GLOBAL ID：200907066870689153   Nikkaji number：J494.307D

Reveromycin D

レベロマイシンD
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： C37H54O11
Molecular formula furigana： C37-H54-O11
Molecular weight： 674.828
InChI： InChI=1S/C37H54O11/c1-6-7-8-20-36(48-35(45)18-17-33(41)42)22-23-37(47-31(36)15-11-26(3)24-34(43)44)21-19-28(5)30(46-37)14-10-25(2)9-13-29(38)27(4)12-16-32(39)40/h9-13,15-16,24,27-31,38H,6-8,14,17-23H2,1-5H3,(H,39,40)(H,41,42)(H,43,44)
InChI key： VYOFNCHDOAZCMT-UHFFFAOYSA-N
SMILES： CCCCCC1(CCC2(CCC(C)C(CC=C(C)C=CC(O)C(C)C=CC(=O)O)O2)OC1C=CC(=CC(=O)O)C)OC(=O)CCC(=O)O
Systematic name  (3)：
  • 5-ヒドロキシ-4,8-ジメチル-10-[9-ペンチル-3-メチル-8-(4-カルボキシ-3-メチル-1,3-ブタジエニル)-9-(4-ヒドロキシ-1,4-ジオキソブトキシ)-1,7-ジオキサスピロ[5.5]ウンデカン-2-イル]-2,6,8-デカトリエン酸
  • 10-[8-(4-カルボキシ-3-メチルブタ-1,3-ジエン-1-イル)-9-[(3-カルボキシプロパノイル)オキシ]-3-メチル-9-ペンチル-1,7-ジオキサスピロ[5.5]ウンデカン-2-イル]-5-ヒドロキシ-4,8-ジメチルデカ-2,6,8-トリエン酸
  • 10-[8-(4-carboxy-3-methylbuta-1,3-dien-1-yl)-9-[(3-carboxypropanoyl)oxy]-3-methyl-9-pentyl-1,7-dioxaspiro[5.5]undecan-2-yl]-5-hydroxy-4,8-dimethyldeca-2,6,8-trienoic acid
Other name (4)：
  • レベロマイシンD
  • Reveromycin D
  • 5-Hydroxy-4,8-dimethyl-10-[9-pentyl-3-methyl-8-(4-carboxy-3-methyl-1,3-butadienyl)-9-(4-hydroxy-1,4-dioxobutoxy)-1,7-dioxaspiro[5.5]undecan-2-yl]-2,6,8-decatrienoic acid
  • リベロマイシンD
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