Chem
J-GLOBAL ID：200907024629919372   Nikkaji number：J1.760.426K

Daphnicycridin K

ダフニシクリジンK
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： C23H27NO6
Molecular formula furigana： C23-H27-N-O6
Molecular weight： 413.470
InChI： InChI=1S/C23H27NO6/c1-11-8-24-9-12-4-5-14-15-13(6-7-30-14)16(20(26)29-3)18-17(15)21(12,2)23(24,28)10-22(18,27)19(11)25/h11-12,27-28H,4-10H2,1-3H3/t11-,12-,21+,22-,23+/m1/s1
InChI key： UWSLHFSILVCIDS-BTLCKZKCSA-N
SMILES： COC(=O)C1=C2CCOC3=C2C2=C1[C@]1(O)C[C@@]4(O)N(C[C@@H](CC3)[C@@]24C)C[C@@H](C)C1=O
Systematic name  (3)：
  • (1R,11S,12S,15R)-8,11,13-[(3S)-ブタン-1,3,4-トリイル]-1,12-ジヒドロキシ-11,15-ジメチル-16-オキソ-7-オキサ-13-アザテトラシクロ[10.4.1.02,10.04,9]ヘプタデカン-2(10),3,8-トリエン-3-カルボン酸メチル
  • メチル (2S,3S,5R,7R,11S)-3,5-ジヒドロキシ-2,7-ジメチル-6-オキソ-15-オキサ-9-アザヘキサシクロ[12.6.1.02,11.03,9.05,20.018,21]ヘンイコサ-1(20),14(21),18-トリエン-19-カルボキシラート
  • methyl (2S,3S,5R,7R,11S)-3,5-dihydroxy-2,7-dimethyl-6-oxo-15-oxa-9-azahexacyclo[12.6.1.02,11.03,9.05,20.018,21]henicosa-1(20),14(21),18-triene-19-carboxylate
Other name (3)：
  • (1R,11S,12S,15R)-8,11,13-[(3S)-Butane-1,3,4-triyl]-1,12-dihydroxy-11,15-dimethyl-16-oxo-7-oxa-13-azatetracyclo[10.4.1.02,10.04,9]heptadecane-2(10),3,8-triene-3-carboxylic acid methyl ester
  • Daphnicycridin K
  • ダフニシクリジンK
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