Cas no 76675-88-2 (Nsc267900)
Nsc267900 structure
Product Name:Nsc267900
CAS No:76675-88-2
MF:C29H38O7
MW:498.60782957077
CID:982847
PubChem ID:320375
Update Time:2025-04-20
Nsc267900 Chemical and Physical Properties
Names and Identifiers
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- Nsc267900
- 76675-88-2
- NSC-267900
- DTXSID40313222
-
- Inchi： 1S/C29H38O7/c1-5-22(31)35-25-24(17-6-9-23(32)33-15-17)28(4)13-11-20-21(29(28)26(25)36-29)8-7-18-14-19(34-16(2)30)10-12-27(18,20)3/h6,9,15,18-21,24-26H,5,7-8,10-14H2,1-4H3
- InChI Key： SQOBVIVBZDIZBF-UHFFFAOYSA-N
- SMILES： O1C2C(C(C3=COC(C=C3)=O)C3(C)CCC4C5(C)CCC(CC5CCC4C132)OC(C)=O)OC(CC)=O
Computed Properties
- Exact Mass: 498.26175355g/mol
- Monoisotopic Mass: 498.26175355g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 36
- Rotatable Bond Count: 6
- Complexity: 1050
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 10
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.4
- Topological Polar Surface Area: 91.4?2
Nsc267900 Related Literature
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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David B. Cordes,Alexandra M. Z. Slawin,Stefania Righetto,Denis Jacquemin,Eli Zysman-Colman,Véronique Guerchais Dalton Trans., 2018,47, 8292-8300
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Eunice Y.-L. Hui,Bhimsen Rout,Yaw Sing Tan,Kok-Ping Chan,Charles W. Johannes Org. Biomol. Chem., 2018,16, 389-392
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