Cas no 126005-69-4 (Kaur-16-en-15-one,7,11,12,14,18-pentahydroxy-, (4b,7a,11b,12a,14R)- (9CI))
126005-69-4 structure
Product Name:Kaur-16-en-15-one,7,11,12,14,18-pentahydroxy-, (4b,7a,11b,12a,14R)- (9CI)
CAS No:126005-69-4
MF:C20H30O6
MW:366.448606967926
CID:172133
Update Time:2024-03-01
Kaur-16-en-15-one,7,11,12,14,18-pentahydroxy-, (4b,7a,11b,12a,14R)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Kaur-16-en-15-one,7,11,12,14,18-pentahydroxy-, (4b,7a,11b,12a,14R)- (9CI)
- (-)-Rabdokunmin E
- 1H-2,10a-Ethanophenanthrene,kaur-16-en-15-one deriv.
- Rabdokunmin E
- Kaur-16-en-15-one, 7,11,12,14,18-pentahydroxy-, (4β,7α,11β,12α,14R)-
-
- Inchi： 1S/C20H30O6/c1-9-12-13(23)14(24)15-19(3)6-4-5-18(2,8-21)10(19)7-11(22)20(15,16(9)25)17(12)26/h10-15,17,21-24,26H,1,4-8H2,2-3H3/t10-,11-,12-,13-,14+,15+,17-,18-,19-,20-/m1/s1
- InChI Key： FUQYFTZWPYGVMC-OGEYPVBISA-N
- SMILES： C=C1[C@@H]2[C@@H](O)[C@H](O)[C@]3([C@@]4(C)[C@@](C[C@@H](O)[C@]3([C@@H]2O)C1=O)([H])[C@@](C)(CO)CCC4)[H]
Computed Properties
- Exact Mass: 272.08309
Experimental Properties
- Density: 1.37±0.1 g/cm3(Predicted)
- Boiling Point: 586.4±50.0 °C(Predicted)
- PSA: 52.54
- pka: 12.56±0.70(Predicted)
Kaur-16-en-15-one,7,11,12,14,18-pentahydroxy-, (4b,7a,11b,12a,14R)- (9CI) Related Literature
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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