Cas no 55708-28-6 (Oogoninol 1)
Oogoninol 1 structure
Product Name:Oogoninol 1
CAS No:55708-28-6
MF:C33H54O6
MW:546.778271198273
CID:2027218
Update Time:2025-04-21
Oogoninol 1 Chemical and Physical Properties
Names and Identifiers
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- Oogoninol 1
- (24R)-11α,15β,29-Trihydroxy-3β-(2-methyl-1-oxopropoxy)stigmast-5-en-7-one
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- Inchi： 1S/C33H54O6/c1-18(2)21(11-13-34)9-8-20(5)24-16-26(36)29-28-25(35)15-22-14-23(39-31(38)19(3)4)10-12-32(22,6)30(28)27(37)17-33(24,29)7/h15,18-21,23-24,26-30,34,36-37H,8-14,16-17H2,1-7H3
- InChI Key： LVAGMWKWSACUNJ-UHFFFAOYSA-N
- SMILES： CC(C(CCC(C1C2(C(C3C(=O)C=C4C(CCC(OC(C(C)C)=O)C4)(C)C3C(C2)O)C(O)C1)C)C)CCO)C
Computed Properties
- Exact Mass: 546.392
- Monoisotopic Mass: 546.392
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 39
- Rotatable Bond Count: 10
- Complexity: 941
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 11
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 104A^2
- XLogP3: 5.483
Oogoninol 1 Related Literature
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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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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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Teresita Carrillo-Hernández,Philippe Schaeffer,Pierre Albrecht Chem. Commun., 2001, 1976-1977
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