Chem
J-GLOBAL ID：200907006446911625   Nikkaji number：J2.204.304H

(1S)-3β,5β-Dihydroxy-2-[2-[(6β)-7β-[(1R)-1-hydroxy-2-methyl-2-butenyl]-1β,3,5,7-tetramethylbicyclo[4.2.0]octa-2,4-diene-8α-yl]-1-propenyl]-1,2β,4β-trimethylcyclopentane-1β-carboxylic acid γ-lactone

(1S)-3β,5β-ジヒドロキシ-2-[2-[(6β)-7β-[(1R)-1-ヒドロキシ-2-メチル-2-ブテニル]-1β,3,5,7-テトラメチルビシクロ[4.2.0]オクタ-2,4-ジエン-8α-イル]-1-プロペニル]-1,2β,4β-トリメチルシクロペンタン-1β-カルボン酸γ-ラクトン
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： C29H42O4
Molecular formula furigana： C29-H42-O4
Molecular weight： 454.651
InChI： InChI=1S/C29H42O4/c1-11-16(3)22(30)28(9)20-17(4)12-15(2)13-26(20,7)21(28)18(5)14-27(8)24-19(6)23(31)29(27,10)25(32)33-24/h11-14,19-24,30-31H,1-10H3/t19-,20-,21+,22+,23+,24-,26+,27+,28+,29-/m0/s1
InChI key： UJDUXVKWZHACIC-HBIRTLPGSA-N
SMILES： CC=C(C)[C@@H](O)[C@@]1(C)[C@H](C(=C[C@]2(C)[C@H]3OC(=O)[C@]2(C)[C@H](O)[C@@H]3C)C)[C@]2(C)C=C(C)C=C(C)[C@H]12
Systematic name  (3)：
  • (1S)-3β,5β-ジヒドロキシ-2-[2-[(6β)-7β-[(1R)-1-ヒドロキシ-2-メチル-2-ブテニル]-1β,3,5,7-テトラメチルビシクロ[4.2.0]オクタ-2,4-ジエン-8α-イル]-1-プロペニル]-1,2β,4β-トリメチルシクロペンタン-1β-カルボン酸γ-ラクトン
  • (1S,4S,5R,6S,7S)-5-ヒドロキシ-7-{2-[(1S,6R,7R,8R)-8-[(1R)-1-ヒドロキシ-2-メチルブタ-2-エン-1-イル]-2,4,6,8-テトラメチルビシクロ[4.2.0]オクタ-2,4-ジエン-7-イル]プロパ-1-エン-1-イル}-4,6,7-トリメチル-2-オキサビシクロ[2.2.1]ヘプタン-3-オン
  • (1S,4S,5R,6S,7S)-5-hydroxy-7-{2-[(1S,6R,7R,8R)-8-[(1R)-1-hydroxy-2-methylbut-2-en-1-yl]-2,4,6,8-tetramethylbicyclo[4.2.0]octa-2,4-dien-7-yl]prop-1-en-1-yl}-4,6,7-trimethyl-2-oxabicyclo[2.2.1]heptan-3-one
Other name (1)：
  • (1S)-3β,5β-Dihydroxy-2-[2-[(6β)-7β-[(1R)-1-hydroxy-2-methyl-2-butenyl]-1β,3,5,7-tetramethylbicyclo[4.2.0]octa-2,4-diene-8α-yl]-1-propenyl]-1,2β,4β-trimethylcyclopentane-1β-carboxylic acid γ-lactone
Thsaurus map：
Thesaurus Map

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