Chem
J-GLOBAL ID:200907093011140732
Nikkaji number:J745.665D
Preoleanatetraene
プレオレアナテトラエン
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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:
C29 H48
Molecular formula furigana:
C29-H48
Molecular weight:
396.703
InChI:
InChI=1S/C29H48/c1-23(2)12-8-13-24(3)14-9-15-25(4)16-10-17-26-18-11-19-29(7)21-20-28(5,6)22-27(26)29/h12,14,16,18,27H,8-11,13,15,17,19-22H2,1-7H3/t27-,29-/m0/s1
InChI key:
XYEMYLXQAZGGOC-YTMVLYRLSA-N
SMILES:
CC(=CCCC(=CCCC(=CCCC1=CCC[C@@]2(C)CCC(C)(C)C[C@@H]12)C)C)C
Systematic name (3):
3,4,4a,5,6,7,8,8aα-オクタヒドロ-4aα,7,7-トリメチル-1-(4,8,12-トリメチル-3,7,11-トリデカトリエニル)ナフタレン
(4aS,8aR)-2,2,4a-トリメチル-8-(4,8,12-トリメチルトリデカ-3,7,11-トリエン-1-イル)-1,2,3,4,4a,5,6,8a-オクタヒドロナフタレン
(4aS,8aR)-2,2,4a-trimethyl-8-(4,8,12-trimethyltrideca-3,7,11-trien-1-yl)-1,2,3,4,4a,5,6,8a-octahydronaphthalene
Other name (3):
プレオレアナテトラエン
Preoleanatetraene
3,4,4a,5,6,7,8,8aα-Octahydro-4aα,7,7-trimethyl-1-(4,8,12-trimethyl-3,7,11-tridecatrienyl)naphthalene
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