Cas no 121817-31-0 (Kaur-16-en-15-one,3,18-bis(acetyloxy)-7,20-epoxy-6,7-dihydroxy-, (3b,4a,6b,7a)- (9CI))
121817-31-0 structure
Product Name:Kaur-16-en-15-one,3,18-bis(acetyloxy)-7,20-epoxy-6,7-dihydroxy-, (3b,4a,6b,7a)- (9CI)
CAS No:121817-31-0
MF:C24H32O8
MW:448.506088256836
CID:234488
Update Time:2024-03-01
Kaur-16-en-15-one,3,18-bis(acetyloxy)-7,20-epoxy-6,7-dihydroxy-, (3b,4a,6b,7a)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Kaur-16-en-15-one,3,18-bis(acetyloxy)-7,20-epoxy-6,7-dihydroxy-, (3b,4a,6b,7a)- (9CI)
- 6,11b-(Epoxymethano)-6a,9-methano-5H-cyclohepta[a]naphthalene,kaur-16-en-15-one deriv.
- Maoecrystal J
- Kaur-16-en-15-one, 3,18-bis(acetyloxy)-7,20-epoxy-6,7-dihydroxy-, (3β,4α,6β,7α)-
-
- Inchi： 1S/C24H32O8/c1-12-15-5-6-16-22-8-7-17(32-14(3)26)21(4,10-30-13(2)25)18(22)20(28)24(29,31-11-22)23(16,9-15)19(12)27/h15-18,20,28-29H,1,5-11H2,2-4H3/t15-,16+,17+,18-,20+,21-,22-,23+,24+/m1/s1
- InChI Key： SLUROFCVEYCYDJ-MIWKWXCYSA-N
- SMILES： C=C1[C@@H]2CC[C@]3([C@@]45CO[C@](O)([C@]3(C2)C1=O)[C@@H](O)[C@]4([H])[C@](C)(COC(C)=O)[C@@H](OC(C)=O)CC5)[H]
Computed Properties
- Exact Mass: 272.08309
Experimental Properties
- Density: 1.35±0.1 g/cm3(Predicted)
- Melting Point: 249-250 °C(Solv: hexane (110-54-3); acetone (67-64-1))
- Boiling Point: 586.8±50.0 °C(Predicted)
- PSA: 52.54
- pka: 11.09±0.70(Predicted)
Kaur-16-en-15-one,3,18-bis(acetyloxy)-7,20-epoxy-6,7-dihydroxy-, (3b,4a,6b,7a)- (9CI) Related Literature
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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