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天丰素 | 78821-43-9

天丰素
Epibrassinolide
78821-43-9
C28H48O6
480.677129745483
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:天丰素结构式
天丰素MSDS
24894426
天丰素价格
简介
Epibrassinolide (24-Epibrassinolide) 是一种广泛存在的植物生长激素,具有缓解植物重金属和农药胁迫潜力。Epibrassinolide (24-Epibrassinolide) 在各种癌细胞中是一种潜在的凋亡诱导剂,而不影响非肿瘤细胞生长。
名称和标识符
MDL MFCD00133310
InChIKey IXVMHGVQKLDRKH-QHBHMFGVSA-N
Inchi 1S/C28H48O6/c1-14(2)15(3)24(31)25(32)16(4)18-7-8-19-17-13-34-26(33)21-11-22(29)23(30)12-28(21,6)20(17)9-10-27(18,19)5/h14-25,29-32H,7-13H2,1-6H3/t15-,16+,17+,18-,19+,20+,21-,22+,23-,24-,25-,27-,28-/m1/s1
SMILES C[C@@]12[C@@H]([C@H](C)[C@@H](O)[C@H](O)[C@H](C)C(C)C)CC[C@H]1[C@@H]1COC(=O)[C@H]3C[C@@H]([C@@H](C[C@]3(C)[C@H]1CC2)O)O
别名信息
- 中文别名 -
  • 天丰素
  • 油菜素内酯
  • 芸苔素内酯
  • 八仙丰产素
  • (22R,23R,24R)-2α,3α,22,23-四羟基-24-甲基-β-均-7-氧杂-5-胆甾-6-酮
  • 表油菜素内酯
  • 24-表油菜素内酯
  • 24-表芸苔素内酯
  • Brassinolide 油菜素内酯 标准品
  • 2,4-表油菜素内酯
- 英文别名 -
  • epibrassinolide
  • Brassinolide
  • 24-Epibrassinolide
  • 24-Epicastasterone
  • 24-epi-brassinolide
  • .(22R,23R,24R)-2
  • 24-(R)-EPIBRASSINOLIDE
  • 3.24-EPIBRASSINOLIDE
  • 4-Epicastasterone
  • B1105
  • BP55
  • BRASSINOLIDE(BR)
  • Brassinolide(epibrassinolide,Homobrassinolide)
  • CH09964 EPIBRASSINOLIDE
  • Epibrassinolide(24-Epibrassinolide)
  • 22R,23R,24R-2α,3α,22,23-Tetrahydroxy-B-homo-7-oxa-5α-ergostan-6-one
  • 22R,23R,24R-2a,3a,22,23-Tetrahydroxy-B-homo-7-oxa-5a-ergostan-6-one
  • CHOLESTAN-6-ONE DERIV
  • NSC325611
  • NSC325306
  • Epibrassinolide R
  • 10-(3,4-dihydroxy-5,6-dimethylheptan-2-yl)-5,6-dihydroxy-7a,9a-dimethylhexadecahydro-3h-benzo[c]indeno[5,4-e]oxepin-3-one
  • 5-Chloro-2-[(5R)-5-methyl-4-[5-methyl-2-(2H-1,2,3-triazol-2-y
  • Epibrassinolide
  • (1S,2R,4R,5S,7S,11S,12S,15R,16S)-15-[(2S,3R,4R,5R)-3,4-dihydroxy-5,6-dimethylheptan-2-yl]-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one
  • Epibrassinolide, >=85%
  • 24(R)-Epibrassinolide
  • Q27103283
  • 78821-43-9
  • 3H-Benz[c]indeno[5,4-e]oxepin-3-one, 10-[(1S,2R,3R,4R)-2,3-dihydroxy-1,4,5-trimethylhexyl]hexadecahydro-5,6-dihydroxy-7a,9a-dimethyl-, (3aS,5S,6R,7aR,7bS,9aS,10R,12aS,12bS)-
  • CHEMBL563853
  • (22R,23R,24R)-2alpha,3alpha,22,23-Tetrahydroxy-b-homo-7-oxa-5alpha-ergostan-6-one
  • 2,3,22,23-Tetrahydroxy-24-methyl-B-homo-7-oxacholestan-6-one
  • 1ST40091
  • HY-N0848
  • Sunergist ebr
  • UNII-49CN25465Y
  • 24-epi-Brassinolide
  • CHEBI:27722
  • 49CN25465Y
  • SCHEMBL1614884
  • B-HOMO-7-OXAERGOSTAN-6-ONE, 2,3,22,23-TETRAHYDROXY-, (2.ALPHA.,3.ALPHA.,5.ALPHA.,22R,23R)-
  • EPIBRASSINOLIDE
  • 6H-Benz(C)indeno(5,4-E)oxepin-6-one, 1-(2,3-dihydroxy-1,4,5-trimethylhexyl)hexadecahydro-8,9-dihydroxy-10a,12a-dimethyl-, (1R-(1alpha(1S*,2R*,3R*,4R*),3abeta,3balpha,6abeta,8beta,9beta,10aalpha,10bbeta,12aalpha))-
  • (1R,3aS,3bS,6aS,8S,9R,10aR,10bS,12aS)-1-((1S,2R,3R,4R)-2,3-Dihydroxy-1,4,5-trimethylhexyl)hexadecahydro-8,9-dihydroxy-10a,12a-dimethyl-6H-benz(C)indeno(5,4-E)oxepin-6-one
  • AKOS027250811
  • (22R,23R)-2alpha,3alpha,22,23-tetrahydroxy-7a-homo-7-oxa-5alpha-ergostan-6-one
  • Brassin lactone
  • LMST01140002
  • B-1105
  • CS-3129
  • AS-76479
  • Epi Brassinolide, 90%
  • B-HOMO-7-oxaergostan-6-one, 2,3,22,23-tetrahydroxy-, (2alpha,3alpha,5alpha,22R,23R)-
  • MFCD00133310
  • 6H-BENZ(C)INDENO(5,4-E)OXEPIN-6-ONE, 1-(2,3-DIHYDROXY-1,4,5-TRIMETHYLHEXYL)HEXADECAHYDRO-8,9-DIHYDROXY-10A,12A-DIMETHYL-, (1R-(1.ALPHA.(1S*,2R*,3R*,4R*),3A.BETA.,3B.ALPHA.,6A.BETA.,8.BETA.,9.BETA.,10A.ALPHA.,10B.BETA.,12A.ALPHA.))-
  • (22R,23R,24R)-2.ALPHA.,3.ALPHA.,22,23-TETRAHYDROXY-B-HOMO-7-OXA-5.ALPHA.-ERGOSTAN-6-ONE
  • s8870
  • 24-Epibrassinolide
  • B1105
  • BP55
  • (1R,3aS,3bS,6aS,8S,9R,10aR,10bS,12aS)-1-[(1S,2R,3R,4R)-2,3-Dihydroxy-1,4,5-trimethylhexyl]hexadecahydro-8,9-dihydroxy-10a,12a-dimethyl-6H-benz[c]indeno[5,4-e]oxepin-6-one (ACI)
  • B-Homo-7-oxaergostan-6-one, 2,3,22,23-tetrahydroxy-, (2α,3α,5α,22R,23R)- (ZCI)
  • (22R,23R,24R)-2α,3α,22,23-Tetrahydroxy-B-homo-7-oxa-5α-ergostan-6-one
  • 6H-Benz[c]indeno[5,4-e]oxepin-6-one, 1-(2,3-dihydroxy-1,4,5-trimethylhexyl)hexadecahydro-8,9-dihydroxy-10a,12a-dimethyl-, [1R-[1α(1S*,2R*,3R*,4R*),3aβ,3bα,6aβ,8β,9β,10aα,10bβ,12aα]]-
  • B 1105
  • BP 55
  • Epin
  • Sunergist EBR
物化性质
实验特性
LogP 3.39000
PSA 107.22000
折射率 1.535
沸点 633.7 oC at 760 mmHg
熔点 256 ºC
闪点 633.7 oC at 760 mmHg
密度 1.141
计算特性
精确分子量 480.34500
氢键供体数量 4
氢键受体数量 6
可旋转化学键数量 5
同位素质量 480.345
重原子数量 34
复杂度 755
同位素原子数量 0
确定原子立构中心数量 13
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 4.8
拓扑分子极性表面积 107
分子量 480.7
生产方法和用途
用途 属广谱性高效植物生长调节剂,对各种经济作物均有明显增产作用,能有效调节植物各个生长环节
合成路线

合成路线:1 步

反应条件:
参考文献:
Improved synthesis of 24-epibrassinolide from ergosterol
McMorris, Trevor C.; Patil, Prakash A., Journal of Organic Chemistry, 1993, 58(8), 2338-9

合成路线:1 步

反应条件:
参考文献:
Steroids. Part CCCLXXIII. New method of preparation of brassinosteroids
Kohout, Ladislav, Collection of Czechoslovak Chemical Communications, 1994, 59(2), 457-60

合成路线:1 步

反应条件:
参考文献:
Biological Activity of Brassinosteroids - Direct Comparison of Known and New Analogs in planta
Wendeborn, Sebastian; Lachia, Mathilde; Jung, Pierre M. J.; Leipner, Joerg; Brocklehurst, David; et al, Helvetica Chimica Acta, 2017, 100(2),

合成路线:1 步

反应条件:
参考文献:
The improved synthesis of epibrassinolide and its application in agriculture
Cheprakov, A. V.; Filatov, M. A.; Lukashev, N. V.; Beletskaya, I. P.; Malevannaya, N. N., Biotechnology, 2006, 41, 41-45

合成路线:1 步

反应条件:
参考文献:
The Baeyer-Villiger oxidation of ketones and aldehydes
Krow, Grant R., Organic Reactions (Hoboken, 1993, 43,

合成路线:1 步

反应条件:
参考文献:
Preparation of brassinosteroids
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相关文献
专业数据库参考
PubChemId 24894426
参考资料
Reaxys RN
产品用途
属广谱性高效植物生长调节剂,对各种经济作物均有明显增产作用,能有效调节植物各个生长环节
960化工网为您提供天丰素专业化合物百科信息,包括中文名,英文名,分子式,分子量,以及该化合物的CasNo.:78821-43-9,和相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等;| WAP 版:78821-43-9
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