Chem
J-GLOBAL ID：200907072408045178   Nikkaji number：J653.370A

(3R,4aβ,6aα)-Tetradecahydro-3β,9-dihydroxy-4,11bα-dimethyl-8α,11aα-methano-9β-(glycyloxymethyl)-11aH-cyclohepta[a]naphthalene-4β-methanol

(3R,4aβ,6aα)-テトラデカヒドロ-3β,9-ジヒドロキシ-4,11bα-ジメチル-8α,11aα-メタノ-9β-(グリシルオキシメチル)-11aH-シクロヘプタ[a]ナフタレン-4β-メタノール
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： C22H37NO5
Molecular formula furigana： C22-H37-N-O5
Molecular weight： 395.540
InChI： InChI=1S/C22H37NO5/c1-19(12-24)16-4-3-14-9-15-10-21(14,20(16,2)6-5-17(19)25)7-8-22(15,27)13-28-18(26)11-23/h14-17,24-25,27H,3-13,23H2,1-2H3/t14-,15+,16-,17+,19-,20-,21-,22-/m0/s1
InChI key： IOASYARYEYRREA-GTPITJCNSA-N
SMILES： C[C@@]1(CO)[C@H](O)CC[C@@]2(C)[C@H]1CC[C@H]1C[C@@H]3C[C@]21CC[C@]3(O)COC(=O)CN
Systematic name  (3)：
  • (3R,4aβ,6aα)-テトラデカヒドロ-3β,9-ジヒドロキシ-4,11bα-ジメチル-8α,11aα-メタノ-9β-(グリシルオキシメチル)-11aH-シクロヘプタ[a]ナフタレン-4β-メタノール
  • [(1S,2S,5R,6R,7R,10S,12R,13R)-5,13-ジヒドロキシ-6-(ヒドロキシメチル)-2,6-ジメチルテトラシクロ[10.3.1.01,10.02,7]ヘキサデカン-13-イル]メチル 2-アミノアセタート
  • [(1S,2S,5R,6R,7R,10S,12R,13R)-5,13-dihydroxy-6-(hydroxymethyl)-2,6-dimethyltetracyclo[10.3.1.01,10.02,7]hexadecan-13-yl]methyl 2-aminoacetate
Other name (1)：
  • (3R,4aβ,6aα)-Tetradecahydro-3β,9-dihydroxy-4,11bα-dimethyl-8α,11aα-methano-9β-(glycyloxymethyl)-11aH-cyclohepta[a]naphthalene-4β-methanol
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