Chem
J-GLOBAL ID：200907043619235798   Nikkaji number：J986.267F

1-Isopropyl-3aβ,5aα-dimethyl-6β-[(2-O,3-O,4-O-triacetyl-β-D-xylopyranosyl)oxy]-2,3,3a,4,5,5a,6,7-octahydrocyclohepta[e]indene-8-carbaldehyde

1-イソプロピル-3aβ,5aα-ジメチル-6β-[(2-O,3-O,4-O-トリアセチル-β-D-キシロピラノシル)オキシ]-2,3,3a,4,5,5a,6,7-オクタヒドロシクロヘプタ[e]インデン-8-カルボアルデヒド
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： C31H42O9
Molecular formula furigana： C31-H42-O9
Molecular weight： 558.668
InChI： InChI=1S/C31H42O9/c1-17(2)22-10-11-30(6)12-13-31(7)23(26(22)30)9-8-21(15-32)14-25(31)40-29-28(39-20(5)35)27(38-19(4)34)24(16-36-29)37-18(3)33/h8-9,15,17,24-25,27-29H,10-14,16H2,1-7H3/t24-,25+,27+,28-,29+,30-,31-/m1/s1
InChI key： ISQDRJBYHSQVMQ-IDOVYDAZSA-N
SMILES： CC(C)C1=C2C3=CC=C(C[C@H](O[C@@H]4OC[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]4OC(=O)C)[C@]3(C)CC[C@@]2(C)CC1)C=O
Systematic name  (3)：
  • 1-イソプロピル-3aβ,5aα-ジメチル-6β-[(2-O,3-O,4-O-トリアセチル-β-D-キシロピラノシル)オキシ]-2,3,3a,4,5,5a,6,7-オクタヒドロシクロヘプタ[e]インデン-8-カルボアルデヒド
  • (3R,4S,5R,6S)-6-{[(3aR,5aR,6S)-8-ホルミル-3a,5a-ジメチル-1-(プロパン-2-イル)-2H,3H,3aH,4H,5H,5aH,6H,7H-シクロヘプタ[e]インデン-6-イル]オキシ}-4,5-ビス(アセチルオキシ)オキサン-3-イル アセタート
  • (3R,4S,5R,6S)-6-{[(3aR,5aR,6S)-8-formyl-3a,5a-dimethyl-1-(propan-2-yl)-2H,3H,3aH,4H,5H,5aH,6H,7H-cyclohepta[e]inden-6-yl]oxy}-4,5-bis(acetyloxy)oxan-3-yl acetate
Other name (1)：
  • 1-Isopropyl-3aβ,5aα-dimethyl-6β-[(2-O,3-O,4-O-triacetyl-β-D-xylopyranosyl)oxy]-2,3,3a,4,5,5a,6,7-octahydrocyclohepta[e]indene-8-carbaldehyde
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM