Chem
J-GLOBAL ID:200907076023335847   Nikkaji number:J1.457.368B

Honulactone E

ホヌラクトンE
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: C32H48O5
Molecular formula furigana: C32-H48-O5
Molecular weight: 512.731
InChI: InChI=1S/C32H48O5/c1-7-20(33)15-26(34)37-25-16-24-29(4)12-8-13-32(17-18(32)2)23(29)11-14-30(24,5)22-10-9-21-19(3)36-28(35)27(21)31(22,25)6/h18-20,22-25,33H,7-17H2,1-6H3/t18-,19-,20?,22-,23+,24+,25-,29-,30-,31+,32-/m0/s1
InChI key: VTWDFCFLADSFES-PSVZLXQZSA-N
SMILES: CCC(O)CC(=O)O[C@H]1C[C@@H]2[C@@]3(C)CCC[C@@]4(C[C@@H]4C)[C@@H]3CC[C@@]2(C)[C@@H]2CCC3=C(C(=O)O[C@H]3C)[C@@]12C
Systematic name  (3):
  • 3-ヒドロキシ吉草酸(4S,2′′S)-2′β,2′′,8-トリメチル-5′-オキソ-2′,5′-ジヒドロスピロ[D-ホモ-5α-アンドロスタノ[17,17a-c]フラン-4,1′′-シクロプロパン]-12α-イル
  • (2'S,3S,5aS,5bR,7aR,8S,11aR,11bR,13S,13aS)-2',3,5b,11a,13a-ペンタメチル-1-オキソ-3,4,5,5a,5b,6,7,7a,9,10,11,11a,11b,12,13,13a-ヘキサデカヒドロ-1H-スピロ[クリセノ[1,2-c]フラン-8,1'-シクロプロパン]-13-イル 3-ヒドロキシペンタノアート
  • (2'S,3S,5aS,5bR,7aR,8S,11aR,11bR,13S,13aS)-2',3,5b,11a,13a-pentamethyl-1-oxo-3,4,5,5a,5b,6,7,7a,9,10,11,11a,11b,12,13,13a-hexadecahydro-1H-spiro[chryseno[1,2-c]furan-8,1'-cyclopropan]-13-yl 3-hydroxypentanoate
Other name (3):
  • 3-Hydroxyvaleric acid (4S,2′′S)-2′β,2′′,8-trimethyl-5′-oxo-2′,5′-dihydrospiro[D-homo-5α-androstano[17,17a-c]furan-4,1′′-cyclopropane]-12α-yl ester
  • ホヌラクトンE
  • Honulactone E
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