Cas no 87164-33-8 (Pisolactone)
Pisolactone structure
Product Name:Pisolactone
CAS No:87164-33-8
MF:C31H50O3
MW:470.726910114288
CID:728982
PubChem ID:14167274
Update Time:2024-03-01
Pisolactone Chemical and Physical Properties
Names and Identifiers
-
- Lanost-8-ene-24-carboxylicacid, 3,22-dihydroxy-, g-lactone, (3b,22S,24R)-(9CI)
- Pisolactone
- UET6Z5DQ5J
- (3R,5S)-5-((1S)-1-((3S,5R,10S,13R,14R,17R)-3-Hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta(a)phenanthren-17-yl)ethyl)-3-isopropyl-tetrahydrofuran-2-one
- 87164-33-8
- LANOST-8-ENE-24-CARBOXYLIC ACID, 3,22-DIHYDROXY-, .GAMMA.-LACTONE, (3.BETA.,22S,24R)-
- (3R,5S)-5-[(1S)-1-[(3S,5R,10S,13R,14R,17R)-3-hydroxy-4,4,10,13,14-pentamethyl-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-17-yl]ethyl]-3-propan-2-yloxolan-2-one
- CHEBI:203238
- UNII-UET6Z5DQ5J
- Lanost-8-ene-24-carboxylic acid, 3,22-dihydroxy-, gamma-lactone, (3beta,22S,24R)-
- Pisolactone-
- (22S)24-Methyllanost-8-en-22,28-epoxy-3beta-ol-28-one
-
- Inchi： 1S/C31H50O3/c1-18(2)20-17-24(34-27(20)33)19(3)21-11-15-31(8)23-9-10-25-28(4,5)26(32)13-14-29(25,6)22(23)12-16-30(21,31)7/h18-21,24-26,32H,9-17H2,1-8H3/t19-,20+,21+,24-,25-,26-,29+,30+,31-/m0/s1
- InChI Key： TWOLTMVJWNRWJQ-DXDFVCSKSA-N
- SMILES： O[C@H]1CC[C@@]2(C)[C@@H](CCC3=C2CC[C@]2(C)[C@@H]([C@H](C)[C@@H]4C[C@H](C(C)C)C(=O)O4)CC[C@]23C)C1(C)C
Computed Properties
- Exact Mass: 470.37599545g/mol
- Monoisotopic Mass: 470.37599545g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 34
- Rotatable Bond Count: 3
- Complexity: 885
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 9
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 46.5
- XLogP3: 7.8
Pisolactone Related Literature
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2. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
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