Chem
J-GLOBAL ID：201407099403405147   Nikkaji number：J3.259.323B

N-(1-Naphthyl)-3β-(1-naphthylcarbamoyloxy)oleana-12-ene-28-amide

N-(1-ナフチル)-3β-(1-ナフチルカルバモイルオキシ)オレアナ-12-エン-28-アミド
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： C51H62N2O3
Molecular formula furigana： C51-H62-N2-O3
Molecular weight： 751.068
InChI： InChI=1S/C51H62N2O3/c1-46(2)28-30-51(44(54)52-39-20-12-16-33-14-8-10-18-35(33)39)31-29-49(6)37(38(51)32-46)22-23-42-48(5)26-25-43(47(3,4)41(48)24-27-50(42,49)7)56-45(55)53-40-21-13-17-34-15-9-11-19-36(34)40/h8-22,38,41-43H,23-32H2,1-7H3,(H,52,54)(H,53,55)/t38-,41-,42+,43-,48-,49+,50+,51-/m0/s1
InChI key： JHGWAQHJCKYGML-MKLSMKKYSA-N
SMILES： CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](OC(=O)Nc6cccc7ccccc67)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)Nc1cccc2ccccc12
Systematic name  (3)：
  • N-(1-ナフチル)-3β-(1-ナフチルカルバモイルオキシ)オレアナ-12-エン-28-アミド
  • (3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4,4,6a,6b,11,11,14b-ヘプタメチル-8a-[(ナフタレン-1-イル)カルバモイル]-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-イコサヒドロピセン-3-イル N-(ナフタレン-1-イル)カルバマート
  • (3S,4aR,6aR,6bS,8aS,12aS,14aR,14bR)-4,4,6a,6b,11,11,14b-heptamethyl-8a-[(naphthalen-1-yl)carbamoyl]-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl N-(naphthalen-1-yl)carbamate
Other name (1)：
  • N-(1-Naphthyl)-3β-(1-naphthylcarbamoyloxy)oleana-12-ene-28-amide
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