Cas no 4847-30-7 (Succinyl oleanolic acid)
Succinyl oleanolic acid structure
Product Name:Succinyl oleanolic acid
CAS No:4847-30-7
MF:C34H52O6
MW:556.773091316223
CID:45362
PubChem ID:10721544
Update Time:2025-04-18
Succinyl oleanolic acid Chemical and Physical Properties
Names and Identifiers
-
- Succinyl oleanolic acid
- (3beta)-3-(3-Carboxy-1-oxopropoxy)-olean-12-en-28-oic acid
- 3-(3-carboxypropanoyloxy)-oleanolic acid
- Oleanolic acid 3-O-succinate
- 4847-30-7
- BDBM50246739
- (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-(4-hydroxy-4-oxo-butanoyl)oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
- CHEMBL446073
- (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-(3-carboxypropanoyloxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
- (4aS,6aS,6bR,8aR,10S,12aR,12bR,14bS)-10-(3-carboxypropanoyloxy)-2,2,6a,6b,9,9,12a-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-4a-carboxylic acid
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- Inchi: 1S/C34H52O6/c1-29(2)16-18-34(28(38)39)19-17-32(6)21(22(34)20-29)8-9-24-31(5)14-13-25(40-27(37)11-10-26(35)36)30(3,4)23(31)12-15-33(24,32)7/h8,22-25H,9-20H2,1-7H3,(H,35,36)(H,38,39)/t22-,23-,24+,25-,31-,32+,33+,34-/m0/s1
- InChI Key: ZLVQQEYNCCJVLQ-VGBCDPHKSA-N
- SMILES: O(C(CCC(=O)O)=O)[C@H]1CC[C@@]2(C)[C@H](C1(C)C)CC[C@@]1(C)[C@]3(C)CC[C@@]4(C(=O)O)CCC(C)(C)C[C@H]4C3=CC[C@@H]12
Computed Properties
- Exact Mass: 556.37638937g/mol
- Monoisotopic Mass: 556.37638937g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 40
- Rotatable Bond Count: 6
- Complexity: 1120
- 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: 7.5
- Topological Polar Surface Area: 101?2
Succinyl oleanolic acid Related Literature
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Fernando J. Reyes-Zurita,Marta Medina-O'Donnell,Rosa M. Ferrer-Martin,Eva E. Rufino-Palomares,Samuel Martin-Fonseca,Francisco Rivas,Antonio Martínez,Andrés García-Granados,Amalia Pérez-Jiménez,Leticia García-Salguero,Juan Peragón,Khalida Mokhtari,Pedro P. Medina,Andrés Parra,José A. Lupiá?ez RSC Adv. 2016 6 93590
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Zhangjian Huang,Yihua Zhang,Li Zhao,Yongwang Jing,Yisheng Lai,Luyong Zhang,Qinglong Guo,Shengtao Yuan,Jianjun Zhang,Li Chen,Sixun Peng,Jide Tian Org. Biomol. Chem. 2010 8 632
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