| InChIKey | NSRJSISNDPOJOP-CZUORRHYSA-N |
| Inchi | 1S/C16H14O4/c1-18-10-3-5-11-13-8-19-14-6-9(17)2-4-12(14)16(13)20-15(11)7-10/h2-7,13,16-17H,8H2,1H3/t13-,16-/m1/s1 |
| SMILES | O1C2C([H])=C(C([H])=C([H])C=2[C@@]2([H])C([H])([H])OC3C([H])=C(C([H])=C([H])C=3[C@@]12[H])O[H])OC([H])([H])[H] |
| LogP | 3.01050 |
| PSA | 47.92000 |
| 熔点 | 127-128 ºC |
| 溶解度 | 几乎不溶 (0.021 g/L) (25 ºC), |
| 密度 | 1.319±0.06 g/cm3 (20 ºC 760 Torr), |
| 精确分子量 | 270.08900 |
| 氢键供体数量 | 1 |
| 氢键受体数量 | 4 |
| 可旋转化学键数量 | 1 |
| 同位素质量 | 270.08920892 g/mol |
| 重原子数量 | 20 |
| 复杂度 | 360 |
| 同位素原子数量 | 0 |
| 确定原子立构中心数量 | 2 |
| 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） | 2.6 |
| 拓扑分子极性表面积 | 47.9 |
| 分子量 | 270.28 |
1.
Synthesis, optical resolution, absolute configuration, and osteogenic activity of cis-pterocarpans
Atul Goel,Amit Kumar,Yasmin Hemberger,Ashutosh Raghuvanshi,Ram Jeet,Govind Tiwari,Michael Knauer,Jyoti Kureel,Anuj K. Singh,Abnish Gautam,Ritu Trivedi,Divya Singh,Gerhard Bringmann Org. Biomol. Chem. 2012 10 9583
2.
Oligomeric isoflavonoids. Part 4.? Synthesis of the daljanelin class of isoflavonoid–neoflavonoid dimers
Mark B. Rohwer,Pieter S. van Heerden,E. Vincent Brandt,Barend C. B. Bezuidenhoudt,Daneel Ferreira J. Chem. Soc. Perkin Trans. 1 1999 3367
3.
Natural product biosynthesis in Medicago species
Azra Gholami,Nathan De Geyter,Jacob Pollier,Sofie Goormachtig,Alain Goossens Nat. Prod. Rep. 2014 31 356
4.
Isoflavonoid biosynthesis: concerning the aryl migration
Hakim A. M. Al-Ani,Paul M. Dewick J. Chem. Soc. Perkin Trans. 1 1984 2831
5.
Synthesis of chromenoindole derivatives from Robinia pseudoacacia
Lisa Dejon,Hamdoon Mohammed,Peng Du,Claus Jacob,Andreas Speicher Med. Chem. Commun. 2013 4 1580
6.
Isoflavonoids of the Leguminosae
Nigel C. Veitch Nat. Prod. Rep. 2009 26 776
7.
Oligomeric isoflavonoids. Part 3. Daljanelins A–D, the first pterocarpan- and isoflavanoid-neoflavonoid analogues
J. Albert Ferreira,Janetta W. Nel,E. Vincent Brandt,Barend C. B. Bezuidenhoudt,Daneel Ferreira J. Chem. Soc. Perkin Trans. 1 1995 1049
8.
Stereochemistry of isoflavone reduction during the biosynthesis of (+)-and (–)-pterocarpans: 2H n.m.r. studies on the biosynthesis of (+)-pisatin and (–)-medicarpin
Stephen W. Banks,Melanie J. Steele,David Ward,Paul M. Dewick J. Chem. Soc. Chem. Commun. 1982 157
9.
Synthesis of isoflavanoid oligomers using a pterocarpan as inceptive electrophile
Barend C. B. Bezuidenhoudt,Edward V. Brandt,David G. Roux J. Chem. Soc. Perkin Trans. 1 1984 2767
10.
Isoflavonoids of the Leguminosae
Nigel C. Veitch Nat. Prod. Rep. 2007 24 417
