Cas no 121817-30-9 (Kaur-16-en-15-one, 18-(acetyloxy)-7,20-epoxy-1,3,6,7-tetrahydroxy-, (1β,3β,4α,6β,7α)-)
121817-30-9 structure
Product Name:Kaur-16-en-15-one, 18-(acetyloxy)-7,20-epoxy-1,3,6,7-tetrahydroxy-, (1β,3β,4α,6β,7α)-
CAS No:121817-30-9
MF:C22H30O8
MW:422.468807697296
CID:205687
Update Time:2024-03-01
Kaur-16-en-15-one, 18-(acetyloxy)-7,20-epoxy-1,3,6,7-tetrahydroxy-, (1β,3β,4α,6β,7α)- Chemical and Physical Properties
Names and Identifiers
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- Kaur-16-en-15-one,18-(acetyloxy)-7,20-epoxy-1,3,6,7-tetrahydroxy-, (1b,3b,4a,6b,7a)-
- MaoecrystalI
- Kaur-16-en-15-one, 18-(acetyloxy)-7,20-epoxy-1,3,6,7-tetrahydroxy-, (1β,3β,4α,6β,7α)-
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- Inchi： 1S/C22H30O8/c1-10-12-4-5-13-20-9-30-22(28,21(13,7-12)17(10)26)18(27)16(20)19(3,8-29-11(2)23)14(24)6-15(20)25/h12-16,18,24-25,27-28H,1,4-9H2,2-3H3
- InChI Key： HMWUNMFAGJJPBJ-UHFFFAOYSA-N
- SMILES： CC(OCC1(C2C3(C4C5(C(=O)C(=C)C(CC4)C5)C(C2O)(O)OC3)C(O)CC1O)C)=O
Computed Properties
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 8
- Heavy Atom Count: 30
- XLogP3: -0.355000000000001
Kaur-16-en-15-one, 18-(acetyloxy)-7,20-epoxy-1,3,6,7-tetrahydroxy-, (1β,3β,4α,6β,7α)- Related Literature
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Alena Koukalová,?árka Pokorná,Aimee L. Boyle,Nestor Lopez Mora,Alexander Kros,Martin Hof,Radek ?achl Nanoscale, 2018,10, 19064-19073
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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Ross Harder,David C. Dunand,Ian McNulty Nanoscale, 2017,9, 5686-5693
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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