Chem
J-GLOBAL ID:200907034660200861   Nikkaji number:J1.151.017E

24-Methylenecycloartan-3-yl 4-hydroxy-3-methoxycinnamate

24-メチレンシクロアルタン-3-イル4-ヒドロキシ-3-メトキシシンナマート
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: C41H60O4
Molecular formula furigana: C41-H60-O4
Molecular weight: 616.927
InChI: InChI=1S/C41H60O4/c1-26(2)27(3)10-11-28(4)30-18-20-39(8)34-16-15-33-37(5,6)35(19-21-40(33)25-41(34,40)23-22-38(30,39)7)45-36(43)17-13-29-12-14-31(42)32(24-29)44-9/h12-14,17,24,26,28,30,33-35,42H,3,10-11,15-16,18-23,25H2,1-2,4-9H3/b17-13+/t28-,30-,33+,34+,35?,38-,39+,40-,41+/m1/s1
InChI key: JBSUVXVGZSMGDJ-NSFZHLBPSA-N
SMILES: COc1cc(/C=C/C(=O)OC2CC[C@]34C[C@@]53CC[C@]3(C)[C@H](CC[C@@]3(C)[C@@H]5CC[C@H]4C2(C)C)[C@H](C)CCC(=C)C(C)C)ccc1O
Systematic name  (4):
  • 24-メチレンシクロアルタン-3-イル4-ヒドロキシ-3-メトキシシンナマート
  • 24-メチレンシクロアルタン-3-オール(E)-3-(4-ヒドロキシ-3-メトキシフェニル)プロペノアート
  • (1S,3R,8R,11S,12S,15R,16R)-7,7,12,16-テトラメチル-15-[(2R)-6-メチル-5-メチリデンヘプタン-2-イル]ペンタシクロ[9.7.0.01,3.03,8.012,16]オクタデカン-6-イル (2E)-3-(4-ヒドロキシ-3-メトキシフェニル)プロパ-2-エノアート
  • (1S,3R,8R,11S,12S,15R,16R)-7,7,12,16-tetramethyl-15-[(2R)-6-methyl-5-methylideneheptan-2-yl]pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-6-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
Other name (2):
  • 24-Methylenecycloartan-3-ol (E)-3-(4-hydroxy-3-methoxyphenyl)propenoate
  • 24-Methylenecycloartan-3-yl 4-hydroxy-3-methoxycinnamate
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