Cas no 53111-19-6 (6beta-(3,4-dimethoxy-benzoyloxy)-8beta,10beta-epoxy-2,3-methanediyldioxy-7beta,8alpha-dimethoxy-17-methyl-hasubanane)
53111-19-6 structure
Product Name:6beta-(3,4-dimethoxy-benzoyloxy)-8beta,10beta-epoxy-2,3-methanediyldioxy-7beta,8alpha-dimethoxy-17-methyl-hasubanane
CAS No:53111-19-6
MF:C29H33NO9
MW:539.573629140854
CID:2032341
Update Time:2025-04-21
6beta-(3,4-dimethoxy-benzoyloxy)-8beta,10beta-epoxy-2,3-methanediyldioxy-7beta,8alpha-dimethoxy-17-methyl-hasubanane Chemical and Physical Properties
Names and Identifiers
-
- 6beta-(3,4-dimethoxy-benzoyloxy)-8beta,10beta-epoxy-2,3-methanediyldioxy-7beta,8alpha-dimethoxy-17-methyl-hasubanane
- N,O,O-Trimethylstephavanine
- N,O7,O4'-trimethyl-stephavanine
-
- Inchi： 1S/C29H33NO9/c1-30-9-8-27-13-24(38-26(31)16-6-7-19(32-2)20(10-16)33-3)25(34-4)29(35-5)28(27,30)14-23(39-29)17-11-21-22(12-18(17)27)37-15-36-21/h6-7,10-12,23-25H,8-9,13-15H2,1-5H3
- InChI Key： AJBWBBGCFSWKKH-UHFFFAOYSA-N
- SMILES： C1C(C(OC2CC34CCN(C)C53C(OC)(OC(C5)C3C=C5C(OCO5)=CC=34)C2OC)=O)=CC=C(OC)C=1OC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 10
- Heavy Atom Count: 39
- XLogP3: 1.3
6beta-(3,4-dimethoxy-benzoyloxy)-8beta,10beta-epoxy-2,3-methanediyldioxy-7beta,8alpha-dimethoxy-17-methyl-hasubanane Related Literature
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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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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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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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