Chem
J-GLOBAL ID:200907009115071405
Nikkaji number:J589.834J
Tirucalla-7,24-dien-3β-ol
チルカラ-7,24-ジエン-3β-オール
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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:
C30 H50 O
Molecular formula furigana:
C30-H50-O
Molecular weight:
426.729
InChI:
InChI=1S/C30H50O/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/h10,12,21-23,25-26,31H,9,11,13-19H2,1-8H3/t21-,22-,23-,25-,26-,28+,29-,30+/m0/s1
InChI key:
DICCPNLDOZNSML-CEEMYSEHSA-N
SMILES:
C[C@@H](CCC=C(C)C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]12C
Systematic name (5):
チルカラ-7,24-ジエン-3β-オール
5α-チルカラ-7,24-ジエン-3β-オール
(20S)-チルカラ-7,24-ジエン-3β-オール
(1S,3aS,5aR,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,5H,5aH,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,5aR,7S,9aR,9bR,11aS)-3a,6,6,9a,11a-pentamethyl-1-[(2S)-6-methylhept-5-en-2-yl]-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-7-ol
Other name (5):
5α-Tirucalla-7,24-dien-3β-ol
Δ7 -チルカロール
Δ7 -Tirucallol
(20S)-Tirucalla-7,24-diene-3β-ol
Tirucalla-7,24-dien-3β-ol
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