Chem
J-GLOBAL ID：200907024636946199   Nikkaji number：J2.773.890G

(24R)-Tirucallane-7,9(11),25-triene-3β,24-diol

(24R)-チルカラン-7,9(11),25-トリエン-3β,24-ジオール
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： C30H48O2
Molecular formula furigana： C30-H48-O2
Molecular weight： 440.712
InChI： InChI=1S/C30H48O2/c1-19(2)24(31)11-9-20(3)21-13-17-30(8)23-10-12-25-27(4,5)26(32)15-16-28(25,6)22(23)14-18-29(21,30)7/h10,14,20-21,24-26,31-32H,1,9,11-13,15-18H2,2-8H3/t20-,21-,24+,25-,26-,28+,29-,30+/m0/s1
InChI key： KRWQHGRXPQWINO-GSNUFDMHSA-N
SMILES： C[C@@H](CC[C@@H](O)C(=C)C)[C@@H]1CC[C@]2(C)C3=CC[C@H]4C(C)(C)[C@@H](O)CC[C@]4(C)C3=CC[C@@]12C
Systematic name  (3)：
  • (24R)-チルカラン-7,9(11),25-トリエン-3β,24-ジオール
  • (1S,3aS,5aR,7S,9aS,11aS)-1-[(2S,5R)-5-ヒドロキシ-6-メチルヘプタ-6-エン-2-イル]-3a,6,6,9a,11a-ペンタメチル-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,11H,11aH-シクロペンタ[a]フェナントレン-7-オール
  • (1S,3aS,5aR,7S,9aS,11aS)-1-[(2S,5R)-5-hydroxy-6-methylhept-6-en-2-yl]-3a,6,6,9a,11a-pentamethyl-1H,2H,3H,3aH,5H,5aH,6H,7H,8H,9H,9aH,11H,11aH-cyclopenta[a]phenanthren-7-ol
Other name (1)：
  • (24R)-Tirucallane-7,9(11),25-triene-3β,24-diol
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