Chem
J-GLOBAL ID：200907071294856816   Nikkaji number：J943.412G

Tirucalla-5,7,24-trien-3β-ol

チルカラ-5,7,24-トリエン-3β-オール
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： C30H48O
Molecular formula furigana： C30-H48-O
Molecular weight： 424.713
InChI： InChI=1S/C30H48O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,12-13,21-23,26,31H,9,11,14-19H2,1-8H3/t21-,22-,23-,26-,28+,29-,30+/m0/s1
InChI key： ZXPSWGLJCXDVOP-HYDGONTMSA-N
SMILES： C[C@@H](CCC=C(C)C)[C@@H]1CC[C@]2(C)C3=CC=C4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]12C
Systematic name  (3)：
  • チルカラ-5,7,24-トリエン-3β-オール
  • (1S,3aS,7S,9aR,9bR,11aS)-3a,6,6,9a,11a-ペンタメチル-1-[(2S)-6-メチルヘプタ-5-エン-2-イル]-1H,2H,3H,3aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-シクロペンタ[a]フェナントレン-7-オール
  • (1S,3aS,7S,9aR,9bR,11aS)-3a,6,6,9a,11a-pentamethyl-1-[(2S)-6-methylhept-5-en-2-yl]-1H,2H,3H,3aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
Other name (1)：
  • Tirucalla-5,7,24-trien-3β-ol
Thsaurus map：
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