Cas no 73246-54-5 ( )
structure
Product Name:
CAS No:73246-54-5
MF:C30H40O5
MW:480.63560962677
CID:977925
PubChem ID:320914
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- methyl 3,10-dihydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylate
- AC1L8381
- Hydroxypristimerin
- HYDROXY-PRISTIMERIN
- NCI60_002205
- NSC270057
- NSC-270057
- 73246-54-5
- DTXSID40313429
- CHEMBL1985284
-
-
- Inchi: 1S/C30H40O5/c1-17-18-8-9-21-27(3,19(18)14-20(31)24(17)33)11-13-30(6)22-15-28(4,25(34)35-7)23(32)16-26(22,2)10-12-29(21,30)5/h8-9,14,22-23,32-33H,10-13,15-16H2,1-7H3
- InChI Key: HDIIUCVOZICRAQ-UHFFFAOYSA-N
- SMILES: OC1C(C(=O)OC)(C)CC2C(C)(C1)CCC1(C)C3=CC=C4C(C)=C(C(C=C4C3(C)CCC21C)=O)O
Computed Properties
- Exact Mass: 480.28757437g/mol
- Monoisotopic Mass: 480.28757437g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 35
- Rotatable Bond Count: 2
- Complexity: 1160
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 7
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.7
- Topological Polar Surface Area: 83.8?2
Related Literature
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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3. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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5. 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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