Chem
J-GLOBAL ID:200907049142220473   Nikkaji number:J665.698F

Stearoylvelutinal

ステアロイルベルチナール
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: C33H56O4
Molecular formula furigana: C33-H56-O4
Molecular weight: 516.807
InChI: InChI=1S/C33H56O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27(34)36-29-32-23-31(32,4)26-22-30(2,3)21-25(26)28-33(32,37-28)24-35-29/h25-26,28-29H,5-24H2,1-4H3/t25-,26+,28+,29+,31-,32+,33+/m1/s1
InChI key: VRKPUGRREPONNX-FUKPGCDFSA-N
SMILES: CCCCCCCCCCCCCCCCCC(=O)O[C@@H]1OC[C@]23O[C@H]2[C@@H]2CC(C)(C)C[C@@H]2[C@@]2(C)C[C@@]132
Systematic name  (3):
  • (1aS,4aS,5aβ,8aβ)-4H-4aβ,5β-エポキシ-1,5,5a,6,7,8,8a,8b-オクタヒドロ-7,7,8bα-トリメチルシクロプロパ[4,5]インデノ[5,6-c]フラン-2α-オールステアラート
  • (1S,3S,4R,8S,9R,11S,12S)-6,6,9-トリメチル-2,13-ジオキサペンタシクロ[9.3.0.01,3.04,8.09,11]テトラデカン-12-イル オクタデカノアート
  • (1S,3S,4R,8S,9R,11S,12S)-6,6,9-trimethyl-2,13-dioxapentacyclo[9.3.0.01,3.04,8.09,11]tetradecan-12-yl octadecanoate
Other name (3):
  • ステアロイルベルチナール
  • Stearoylvelutinal
  • (1aS,4aS,5aβ,8aβ)-4H-4aβ,5β-Epoxy-1,5,5a,6,7,8,8a,8b-octahydro-7,7,8bα-trimethylcyclopropa[4,5]indeno[5,6-c]furan-2α-ol stearate
CAS registry number: 86562-14-3
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