Cas no 78493-10-4 (Adenosine,2'-deoxy-N-[(12-methylbenz[a]anthracen-7-yl)methyl]- (9CI))
78493-10-4 structure
Product Name:Adenosine,2'-deoxy-N-[(12-methylbenz[a]anthracen-7-yl)methyl]- (9CI)
CAS No:78493-10-4
MF:C30H27N5O3
MW:505.567086458206
CID:563746
PubChem ID:174143
Update Time:2025-04-19
Adenosine,2'-deoxy-N-[(12-methylbenz[a]anthracen-7-yl)methyl]- (9CI) Chemical and Physical Properties
Names and Identifiers
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- Adenosine,2'-deoxy-N-[(12-methylbenz[a]anthracen-7-yl)methyl]- (9CI)
- N(6)-(12-methylbenzanthracenyl-7-methyl)deoxyadenosine
- 78493-10-4
- (2R,3S,5R)-2-(hydroxymethyl)-5-[6-[(12-methylbenzo[a]anthracen-7-yl)methylamino]purin-9-yl]oxolan-3-ol
- 9-(2-Deoxypentofuranosyl)-N-[(12-methyltetraphen-7-yl)methyl]-9H-purin-6-amine
- Mbamda
- N(6)-(12-Methylbenz(a)anthracenyl-7-methyl)deoxyadenosine
- DTXSID90999797
- Adenosine, 2'-deoxy-N-((12-methylbenz(a)anthracen-7-yl)methyl)-
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- Inchi: 1S/C30H27N5O3/c1-17-19-7-4-5-9-21(19)23(22-11-10-18-6-2-3-8-20(18)27(17)22)13-31-29-28-30(33-15-32-29)35(16-34-28)26-12-24(37)25(14-36)38-26/h2-11,15-16,24-26,36-37H,12-14H2,1H3,(H,31,32,33)/t24-,25+,26+/m0/s1
- InChI Key: QTJKRASRUTVRSR-JIMJEQGWSA-N
- SMILES: O1[C@H](CO)[C@H](C[C@@H]1N1C=NC2C(=NC=NC1=2)NCC1C2C=CC=CC=2C(C)=C2C3C=CC=CC=3C=CC=12)O
Computed Properties
- Exact Mass: 505.21138974g/mol
- Monoisotopic Mass: 505.21138974g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 38
- Rotatable Bond Count: 5
- Complexity: 819
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 3
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 5.4
- Topological Polar Surface Area: 105?2
Adenosine,2'-deoxy-N-[(12-methylbenz[a]anthracen-7-yl)methyl]- (9CI) Related Literature
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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Nduka Ikpo,Jenna C. Flogeras,Francesca M. Kerton Dalton Trans., 2013,42, 8998-9006
78493-10-4 (Adenosine,2'-deoxy-N-[(12-methylbenz[a]anthracen-7-yl)methyl]- (9CI)) Related Products
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