Cas no 798548-48-8 (20,25-Epoxy-3,16,24-trihydroxycucurbit-5-ene-2,11,22-trione; (3α,16α,20S,24R)-form, 24-Et ether)
798548-48-8 structure
Product Name:20,25-Epoxy-3,16,24-trihydroxycucurbit-5-ene-2,11,22-trione; (3α,16α,20S,24R)-form, 24-Et ether
CAS No:798548-48-8
MF:C32H48O7
MW:544.719330787659
CID:6758520
Update Time:2024-03-03
20,25-Epoxy-3,16,24-trihydroxycucurbit-5-ene-2,11,22-trione; (3α,16α,20S,24R)-form, 24-Et ether Chemical and Physical Properties
Names and Identifiers
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- 20,25-Epoxy-3,16,24-trihydroxycucurbit-5-ene-2,11,22-trione; (3α,16α,20S,24R)-form, 24-Et ether
-
- Inchi： 1S/C32H48O7/c1-10-38-24-14-22(35)32(9,39-28(24,4)5)25-20(34)15-29(6)21-12-11-17-18(13-19(33)26(37)27(17,2)3)31(21,8)23(36)16-30(25,29)7/h11,18,20-21,24-26,34,37H,10,12-16H2,1-9H3
- InChI Key： GPFCTBZKSDGUFM-UHFFFAOYSA-N
- SMILES： CCOC1C(C)(C)OC(C2C3(C(C4C(C(C3)=O)(C)C3CC(C(C(C3=CC4)(C)C)O)=O)(C)CC2O)C)(C)C(=O)C1
Computed Properties
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 39
- XLogP3: 2.022
20,25-Epoxy-3,16,24-trihydroxycucurbit-5-ene-2,11,22-trione; (3α,16α,20S,24R)-form, 24-Et ether Related Literature
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
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J. Xu,T. J. Carrocci,A. A. Hoskins Chem. Commun., 2016,52, 549-552
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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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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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