Chem
J-GLOBAL ID：200907000724067670   Nikkaji number：J1.303.949F

Selamectin

セラメクチン
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： C43H63NO11
Molecular formula furigana： C43-H63-N-O11
Molecular weight： 769.973
InChI： InChI=1S/C43H63NO11/c1-24-11-10-14-30-23-50-40-36(44-48)27(4)19-33(43(30,40)47)41(46)52-32-20-31(16-15-25(2)38(24)53-35-21-34(49-6)37(45)28(5)51-35)54-42(22-32)18-17-26(3)39(55-42)29-12-8-7-9-13-29/h10-11,14-15,19,24,26,28-29,31-35,37-40,45,47-48H,7-9,12-13,16-18,20-23H2,1-6H3/b11-10+,25-15+,30-14+,44-36-/t24-,26-,28-,31+,32-,33-,34-,35-,37-,38-,39-,40+,42+,43+/m0/s1
InChI key： AFJYYKSVHJGXSN-XHKIUTQPSA-N
SMILES： CO[C@H]1C[C@H](O[C@H]2[C@@H](C)/C=C/C=C/3\CO[C@@H]4/C(=N\O)/C(=C[C@@H](C(=O)O[C@H]5C[C@@H](C/C=C/2\C)O[C@@]2(CC[C@H](C)[C@H](O2)C2CCCCC2)C5)[C@]34O)C)O[C@@H](C)[C@@H]1O
Systematic name  (3)：
  • (5Z,13S)-5-デメトキシ-5-(ヒドロキシイミノ)-22,23-ジヒドロ-25-デ(1-メチルプロピル)-25-シクロヘキシル-4′-O-デ(3-O-メチル-2,6-ジデオキシ-α-L-arabino-ヘキソピラノシル)アベルメクチンA1a
  • (1'R,2R,4'S,5S,6S,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'Z,24'S)-6-シクロヘキシル-24'-ヒドロキシ-12'-{[(2R,4S,5S,6S)-5-ヒドロキシ-4-メトキシ-6-メチルオキサン-2-イル]オキシ}-21'-(ヒドロキシイミノ)-5,11',13',22'-テトラメチル-3',7',19'-トリオキサスピロ[オキサン-2,6'-テトラシクロ[15.6.1.14,8.020,24]ペンタコサン]-10',14',16',22'-テトラエン-2'-オン
  • (1'R,2R,4'S,5S,6S,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'Z,24'S)-6-cyclohexyl-24'-hydroxy-12'-{[(2R,4S,5S,6S)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-21'-(hydroxyimino)-5,11',13',22'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.14,8.020,24]pentacosane]-10',14',16',22'-tetraen-2'-one
Other name (4)：
  • (5Z,13S)-5-Demethoxy-5-(hydroxyimino)-22,23-dihydro-25-de(1-methylpropyl)-25-cyclohexyl-4′-O-de(3-O-methyl-2,6-dideoxy-α-L-arabino-hexopyranosyl)avermectin A1a
  • セラメクチン
  • Selamectin
  • (5Z,13S)-5-デメトキシ-5-(ヒドロキシイミノ)-22,23-ジヒドロ-25-デ(1-メチルプロピル)-25-シクロヘキシル-4′-O-デ(3-O-メチル-2,6-ジデオキシ-α-L-arabino-ヘキソピラノシル)エバーメクチンA1a
Application (1)：
acaricide
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM