Cas no 469-48-7 (3beta,15beta,22alpha-trihydroxy-olean-12-en-28-oic acid-15-lactone)
469-48-7 structure
Product Name:3beta,15beta,22alpha-trihydroxy-olean-12-en-28-oic acid-15-lactone
CAS No:469-48-7
MF:C30H46O4
MW:470.683849811554
CID:2007672
Update Time:2025-04-21
3beta,15beta,22alpha-trihydroxy-olean-12-en-28-oic acid-15-lactone Chemical and Physical Properties
Names and Identifiers
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- 3beta,15beta,22alpha-trihydroxy-olean-12-en-28-oic acid-15-lactone
- 3beta,15beta,22alpha-Trihydroxy-olean-12-en-28-saeure-15-lacton
- 3β,15β,22α-Trihydroxyolean-12-en-28-oic acid γ-lactone
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- Inchi: 1S/C30H46O4/c1-25(2)14-18-17-8-9-20-27(5)12-11-21(31)26(3,4)19(27)10-13-28(20,6)29(17,7)23-16-30(18,22(32)15-25)24(33)34-23/h8,18-23,31-32H,9-16H2,1-7H3
- InChI Key: PJICFKSSJHWPPN-UHFFFAOYSA-N
- SMILES: CC1(CC2C3(C(=O)OC(C4(C5(C(C6(C(CC5)C(C)(C)C(O)CC6)C)CC=C42)C)C)C3)C(O)C1)C
Computed Properties
- Exact Mass: 470.34
- Monoisotopic Mass: 470.34
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 34
- Rotatable Bond Count: 0
- Complexity: 965
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 10
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 66.8A^2
3beta,15beta,22alpha-trihydroxy-olean-12-en-28-oic acid-15-lactone Related Literature
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Qiyuan Wu,Shangmin Xiong,Peichuan Shen,Shen Zhao,Alexander Orlov Catal. Sci. Technol., 2015,5, 2059-2064
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Zhizhen Lai,Mo Zhang,Jinyu Zhou,Tianjing Chen,Dan Li,Xuejing Shen,Jia Liu,Jiang Zhou,Zhili Li Analyst, 2021,146, 4261-4267
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Helga Garcia,Rui Ferreira,Marija Petkovic,Jamie L. Ferguson,Maria C. Leit?o,H. Q. Nimal Gunaratne,Luís Paulo N. Rebelo Green Chem., 2010,12, 367-369
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