Cas no 126005-67-2 (Kaur-16-en-15-one,7,12,14,18-tetrahydroxy-, (4b,7a,12a,14R)-)
126005-67-2 structure
Product Name:Kaur-16-en-15-one,7,12,14,18-tetrahydroxy-, (4b,7a,12a,14R)-
CAS No:126005-67-2
MF:C20H30O5
MW:350.449206829071
CID:174436
Update Time:2024-03-01
Kaur-16-en-15-one,7,12,14,18-tetrahydroxy-, (4b,7a,12a,14R)- Chemical and Physical Properties
Names and Identifiers
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- Kaur-16-en-15-one,7,12,14,18-tetrahydroxy-, (4b,7a,12a,14R)-
- (-)-RabdokunminC
- Rabdokunmin C
- Kaur-16-en-15-one, 7,12,14,18-tetrahydroxy-, (4β,7α,12α,14R)-
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- Inchi: 1S/C20H30O5/c1-10-15-11(22)7-13-19(3)6-4-5-18(2,9-21)12(19)8-14(23)20(13,16(10)24)17(15)25/h11-15,17,21-23,25H,1,4-9H2,2-3H3/t11-,12+,13-,14+,15+,17+,18+,19+,20-/m0/s1
- InChI Key: LHIPFIWSRZRQBF-CQUQCLBPSA-N
- SMILES: OC[C@@]1([C@H]2C[C@H]([C@@]34C(=O)C(=C)[C@@H]([C@H]3O)[C@@H](O)C[C@H]4[C@]2(C)CCC1)O)C
Computed Properties
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 25
- XLogP3: 0.62
Kaur-16-en-15-one,7,12,14,18-tetrahydroxy-, (4b,7a,12a,14R)- Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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