Chem
J-GLOBAL ID:200907067764471234   Nikkaji number:J7.904I

Troleandomycin

トロレアンドマイシン
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: C41H67NO15
Molecular formula furigana: C41-H67-N-O15
Molecular weight: 813.979
InChI: InChI=1S/C41H67NO15/c1-19-17-41(18-49-41)38(46)23(5)34(53-27(9)43)21(3)25(7)52-39(47)24(6)35(56-32-16-31(48-14)36(26(8)51-32)54-28(10)44)22(4)33(19)57-40-37(55-29(11)45)30(42(12)13)15-20(2)50-40/h19-26,30-37,40H,15-18H2,1-14H3/t19-,20+,21-,22+,23+,24+,25+,26-,30-,31-,32-,33-,34-,35?,36-,37+,40-,41+/m0/s1
InChI key: LQCLVBQBTUVCEQ-FBZTUZAPSA-N
SMILES: CO[C@H]1C[C@H](OC2[C@H](C)[C@@H](O[C@@H]3O[C@H](C)C[C@@H]([C@H]3OC(=O)C)N(C)C)[C@@H](C)C[C@@]3(CO3)C(=O)[C@H](C)[C@@H](OC(=O)C)[C@@H](C)[C@@H](C)OC(=O)[C@@H]2C)O[C@@H](C)[C@@H]1OC(=O)C
Systematic name  (4):
  • 2′′-O,4′-O,11-O-トリアセチルオレアンドマイシン
  • オレアンドマイシントリアセタート
  • (3R,5R,6S,7S,8R,11R,12S,13R,14S,15S)-14-{[(2S,3R,4S,6R)-3-(アセチルオキシ)-4-(ジメチルアミノ)-6-メチルオキサン-2-イル]オキシ}-12-{[(2R,4S,5S,6S)-5-(アセチルオキシ)-4-メトキシ-6-メチルオキサン-2-イル]オキシ}-5,7,8,11,13,15-ヘキサメチル-4,10-ジオキソ-1,9-ジオキサスピロ[2.13]ヘキサデカン-6-イル アセタート
  • (3R,5R,6S,7S,8R,11R,12S,13R,14S,15S)-14-{[(2S,3R,4S,6R)-3-(acetyloxy)-4-(dimethylamino)-6-methyloxan-2-yl]oxy}-12-{[(2R,4S,5S,6S)-5-(acetyloxy)-4-methoxy-6-methyloxan-2-yl]oxy}-5,7,8,11,13,15-hexamethyl-4,10-dioxo-1,9-dioxaspiro[2.13]hexadecan-6-yl acetate
Other name (21):
  • トロレアンドミシン
  • トロレアンドマイシン
  • NSC-108166
  • Troleandomycin
  • タオシン
Show all
CAS registry number: 2751-09-9
Regulation number (3):
  • RJ9900000
  • EINECS2203929
  • (9)-2288
KEGG DRUG: D01322
KEGG COMPOUND: C12753
Application (1):
antibacterial drug
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