Chem
J-GLOBAL ID：200907026961481294   Nikkaji number：J1.353.864F

Cladosporide A

クラドスポリドA
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： C25H40O3
Molecular formula furigana： C25-H40-O3
Molecular weight： 388.592
InChI： InChI=1S/C25H40O3/c1-16(14-26)17-8-12-25(5)19-6-7-20-22(2,18(19)9-13-24(17,25)4)11-10-21(28)23(20,3)15-27/h15-17,20-21,26,28H,6-14H2,1-5H3/t16-,17-,20-,21+,22-,23-,24-,25+/m1/s1
InChI key： IMFPTRFAGTZUCB-KGEWIPHDSA-N
SMILES： C[C@H](CO)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]1(C)CC[C@H](O)[C@](C)(C=O)[C@@H]1CC3
Systematic name  (3)：
  • 3β,22-ジヒドロキシ-23,24,25,26,27-ペンタノル-5α-ラノスタ-8-エン-29-アール
  • (1R,3aR,5aR,6R,7S,9aS,11aR)-7-ヒドロキシ-1-[(2S)-1-ヒドロキシプロパン-2-イル]-3a,6,9a,11a-テトラメチル-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-シクロペンタ[a]フェナントレン-6-カルバルデヒド
  • (1R,3aR,5aR,6R,7S,9aS,11aR)-7-hydroxy-1-[(2S)-1-hydroxypropan-2-yl]-3a,6,9a,11a-tetramethyl-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthrene-6-carbaldehyde
Other name (3)：
  • 3β,22-Dihydroxy-23,24,25,26,27-pentanor-5α-lanosta-8-ene-29-al
  • クラドスポリドA
  • Cladosporide A
CAS registry number： 310897-84-8
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