Chem
J-GLOBAL ID：201307044463551880   Nikkaji number：J3.149.488E

Thermolide D

テルモリド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： C26H49NO8
Molecular formula furigana： C26-H49-N-O8
Molecular weight： 503.677
InChI： InChI=1S/C26H49NO8/c1-13-8-15(3)25(16(4)9-14(2)24(33)18(6)22(31)10-17(5)28)35-26(34)19(7)27-23(32)12-20(29)11-21(13)30/h13-22,24-25,28-31,33H,8-12H2,1-7H3,(H,27,32)/t13-,14+,15-,16+,17+,18-,19-,20+,21+,22-,24+,25?/m1/s1
InChI key： YTSFNNAINMASAI-MZPIKMFESA-N
SMILES： C[C@H](O)C[C@@H](O)[C@@H](C)[C@@H](O)[C@@H](C)C[C@H](C)C1OC(=O)[C@@H](C)NC(=O)C[C@@H](O)C[C@H](O)[C@H](C)C[C@H]1C
Systematic name  (3)：
  • (2R,6S,8S,9R,11R,12R)-6,8-ジヒドロキシ-2,9,11-トリメチル-12-[(1S,3S,4S,5R,6R,8S)-4,6,8-トリヒドロキシ-1,3,5-トリメチルノニル]-13-オキサ-3-アザシクロトリデカン-1,4-ジオン
  • (3R,7S,9S,10R,12R,13R)-7,9-ジヒドロキシ-3,10,12-トリメチル-13-[(2S,4S,5S,6R,7R,9S)-5,7,9-トリヒドロキシ-4,6-ジメチルデカン-2-イル]-1-オキサ-4-アザシクロトリデカン-2,5-ジオン
  • (3R,7S,9S,10R,12R,13R)-7,9-dihydroxy-3,10,12-trimethyl-13-[(2S,4S,5S,6R,7R,9S)-5,7,9-trihydroxy-4,6-dimethyldecan-2-yl]-1-oxa-4-azacyclotridecane-2,5-dione
Other name (3)：
  • (2R,6S,8S,9R,11R,12R)-6,8-Dihydroxy-2,9,11-trimethyl-12-[(1S,3S,4S,5R,6R,8S)-4,6,8-trihydroxy-1,3,5-trimethylnonyl]-13-oxa-3-azacyclotridecane-1,4-dione
  • テルモリドD
  • Thermolide D
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