Cas no 221104-74-1 ((3β,\u200b5α)\u200b-Ergosta-\u200b7,\u200b24(28)\u200b-\u200bdien-\u200b25,\u200b26,\u200b26,\u200b26,\u200b27,\u200b27,\u200b27-\u200bd7-\u200b3-\u200bol)
221104-74-1 structure
Product Name:(3β,\u200b5α)\u200b-Ergosta-\u200b7,\u200b24(28)\u200b-\u200bdien-\u200b25,\u200b26,\u200b26,\u200b26,\u200b27,\u200b27,\u200b27-\u200bd7-\u200b3-\u200bol
CAS No:221104-74-1
MF:C28H46O
MW:405.707380771637
CID:5725093
PubChem ID:131708870
Update Time:2023-11-22
(3β,\u200b5α)\u200b-Ergosta-\u200b7,\u200b24(28)\u200b-\u200bdien-\u200b25,\u200b26,\u200b26,\u200b26,\u200b27,\u200b27,\u200b27-\u200bd7-\u200b3-\u200bol Chemical and Physical Properties
Names and Identifiers
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- (3beta,5alpha)-Ergosta-7,24(28)-dien-25,26,26,26,27,27,27-d7-3-ol
- 221104-74-1
- (3β,\u200b5α)\u200b-Ergosta-\u200b7,\u200b24(28)\u200b-\u200bdien-\u200b25,\u200b26,\u200b26,\u200b26,\u200b27,\u200b27,\u200b27-\u200bd7-\u200b3-\u200bol
-
- Inchi: 1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h10,18,20-22,24-26,29H,3,7-9,11-17H2,1-2,4-6H3/t20-,21+,22+,24-,25+,26+,27+,28-/m1/s1/i1D3,2D3,18D
- InChI Key: BTCAEOLDEYPGGE-IZNMUTCZSA-N
- SMILES: O[C@H]1CC[C@@]2(C)[C@H](C1)CC=C1[C@@H]2CC[C@]2(C)[C@@H]([C@H](C)CCC(=C)C([2H])(C([2H])([2H])[2H])C([2H])([2H])[2H])CC[C@H]21
Computed Properties
- Exact Mass: 405.398803308g/mol
- Monoisotopic Mass: 405.398803308g/mol
- Isotope Atom Count: 7
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 29
- Rotatable Bond Count: 5
- Complexity: 659
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 8
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 8.4
- Topological Polar Surface Area: 20.2?2
(3β,\u200b5α)\u200b-Ergosta-\u200b7,\u200b24(28)\u200b-\u200bdien-\u200b25,\u200b26,\u200b26,\u200b26,\u200b27,\u200b27,\u200b27-\u200bd7-\u200b3-\u200bol Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | E599180-1mg |
(3β,\u200b5α)\u200b-Ergosta-\u200b7,\u200b24(28)\u200b-\u200bdien-\u200b25,\u200b26,\u200b26,\u200b26,\u200b27,\u200b27,\u200b27-\u200bd7-\u200b3-\u200bol |
221104-74-1 | 1mg |
$ 190.00 | 2023-04-17 | ||
| TRC | E599180-10mg |
(3β,\u200b5α)\u200b-Ergosta-\u200b7,\u200b24(28)\u200b-\u200bdien-\u200b25,\u200b26,\u200b26,\u200b26,\u200b27,\u200b27,\u200b27-\u200bd7-\u200b3-\u200bol |
221104-74-1 | 10mg |
$ 1499.00 | 2023-04-17 |
(3β,\u200b5α)\u200b-Ergosta-\u200b7,\u200b24(28)\u200b-\u200bdien-\u200b25,\u200b26,\u200b26,\u200b26,\u200b27,\u200b27,\u200b27-\u200bd7-\u200b3-\u200bol Related Literature
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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