Chem
J-GLOBAL ID：201507026894029184   Nikkaji number：J3.344.480J

Mangromicin B

マングロマイシンB
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： C22H32O6
Molecular formula furigana： C22-H32-O6
Molecular weight： 392.492
InChI： InChI=1S/C22H32O6/c1-5-6-14-18-10-16(23)12(2)9-17(24)20-13(3)11-22(4,28-20)8-7-15(19(14)25)21(26)27-18/h9,13-14,17-18,20,24-25H,5-8,10-11H2,1-4H3/t13-,14+,17+,18+,20+,22-/m0/s1
InChI key： AFAXFXGTXQUJRU-UMVROHSUSA-N
SMILES： CCC[C@@H]1[C@H]2CC(=O)C(=C[C@@H](O)[C@@H]3O[C@](C)(C[C@@H]3C)CCC(=C1O)C(=O)O2)C
Systematic name  (3)：
  • (4S,6S,7R,8R,13R,14R)-4,6,10-トリメチル-8,15-ジヒドロキシ-14-プロピル-17,18-ジオキサトリシクロ[11.2.2.14,7]オクタデカン-1(15),9-ジエン-11,16-ジオン
  • (4S,6S,7R,8R,13R,17R)-8,16-ジヒドロキシ-4,6,10-トリメチル-17-プロピル-14,18-ジオキサトリシクロ[11.2.2.14,7]オクタデカ-1(16),9-ジエン-11,15-ジオン
  • (4S,6S,7R,8R,13R,17R)-8,16-dihydroxy-4,6,10-trimethyl-17-propyl-14,18-dioxatricyclo[11.2.2.14,7]octadeca-1(16),9-diene-11,15-dione
Other name (3)：
  • (4S,6S,7R,8R,13R,14R)-4,6,10-Trimethyl-8,15-dihydroxy-14-propyl-17,18-dioxatricyclo[11.2.2.14,7]octadecane-1(15),9-diene-11,16-dione
  • マングロマイシンB
  • Mangromicin B
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