Cas no 137694-17-8 (N/A)
N/A structure
Product Name:N/A
CAS No:137694-17-8
MF:C20H26O6
MW:362.416846752167
CID:2078638
PubChem ID:15386743
Update Time:2025-04-21
N/A Chemical and Physical Properties
Names and Identifiers
-
- Gibberellin A115
- GA116
- GA115
- DTXSID801121893
- 137694-17-8
- (1I+/-,4aI+/-,4bI(2),6I+/-,10I(2))-4a-Formyl-6-hydroxy-1-methyl-8-methylenegibbane-1,10-dicarboxylic acid
- (1alpha,4aalpha,4bbeta,6alpha,10beta)-4a-Formyl-6-hydroxy-1-methyl-8-methylenegibbane-1,10-dicarboxylic acid
- N/A
-
- Inchi： 1S/C20H26O6/c1-10-7-20-8-11(10)12(22)6-13(20)19(9-21)5-3-4-18(2,17(25)26)15(19)14(20)16(23)24/h9,11-15,22H,1,3-8H2,2H3,(H,23,24)(H,25,26)
- InChI Key： ABTNJGAZZKYLLD-UHFFFAOYSA-N
- SMILES： CC1(C2C(C3C4(C2C(=O)O)CC(C(C4)C(O)C3)=C)(C=O)CCC1)C(=O)O
Computed Properties
- Exact Mass: 362.17293854Da
- Monoisotopic Mass: 362.17293854Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 26
- Rotatable Bond Count: 3
- Complexity: 715
- 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: 0.736
- Topological Polar Surface Area: 112?2
N/A Related Literature
-
Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
-
Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
-
Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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