Cas no 89157-12-0 (sarcinapterin)
sarcinapterin structure
Product Name:sarcinapterin
CAS No:89157-12-0
MF:C35H48N7O19P
MW:901.764890670776
CID:723192
Update Time:2024-03-01
sarcinapterin Chemical and Physical Properties
Names and Identifiers
-
- sarcinapterin
- 5'-ester with1-[4-[[(1R)-1-(2-amino-1,4-dihydro-7-methyl-4-oxo-6-pteridinyl)ethyl]amino]phenyl]-1-deoxy-5-O-a-D-ribofuranosyl-D-r
- 5'-ester with1-[4-[[(1R)-1-(2-amino-1,4-dihydro-7-methyl-4-oxo-6-pteridinyl)ethyl]amino]phenyl]-1-deoxy-5-O-a-D-ribofuranosyl-D-ribitol (9CI)
- L-Glutamic acid,N-[(2S)-4-carboxy-1-oxo-2-(phosphonooxy)butyl]-, P®
- (2S)-2-{[(2S)-2-{[{[(2R,3S,4R,5S)-5-{[(2R,3S,4S)-5-(4-{[(1R)-1-(2-amino-7-methyl-4-oxo-4,8-dihydropteridin-6-yl)ethyl]amino}phenyl)-2,3,4-trihydroxypentyl]oxy}-3,4-dihydroxytetrahydrofuran-2-yl]methoxy}(hydroxy)phosphoryl]oxy}-4-carboxybutanoyl]amino}pentanedioic acid
- alpha-Glutamylmethanopterin
- 1-(4-((1-(2-Amino-1,4-dihydro-7-methyl-4-oxo-6-pteridinyl)ethyl)amino)phenyl)-5-O-(5-O-((3-carboxy-1-(((1,3-dicarboxypropyl)amino)carbonyl)propoxy)hydroxyphosphinyl)-
- CID 135911942
- L-Glutamic acid, N-[(2S)-4-carboxy-1-oxo-2-(phosphonooxy)butyl]-, P→5'-ester with 1-[4-[[(1R)-1-(2-amino-1,4-dihydro-7-methyl-4-oxo-6-pteridinyl)ethyl]amino]phenyl]-1-deoxy-5-O-α-D-ribofuranosyl-D-ribitol (9CI)
-
- Inchi: 1S/C35H48N7O19P/c1-14(25-15(2)38-30-26(40-25)32(53)42-35(36)41-30)37-17-5-3-16(4-6-17)11-19(43)27(49)20(44)12-58-34-29(51)28(50)22(60-34)13-59-62(56,57)61-21(8-10-24(47)48)31(52)39-18(33(54)55)7-9-23(45)46/h3-6,14,18-22,27-29,34,37,43-44,49-51H,7-13H2,1-2H3,(H,39,52)(H,45,46)(H,47,48)(H,54,55)(H,56,57)(H3,36,38,41,42,53)/t14-,18+,19+,20-,21+,22-,27+,28-,29-,34+/m1/s1
- InChI Key: ZZZXRXDSTUEPEK-VBKPQRTLSA-N
- SMILES: P(=O)(O)(O[C@H](C(N[C@H](C(=O)O)CCC(=O)O)=O)CCC(=O)O)OC[C@@H]1[C@H]([C@H]([C@@H](OC[C@H]([C@H]([C@H](CC2C=CC(=CC=2)N[C@H](C)C2C(C)=NC3=C(C(NC(N)=N3)=O)N=2)O)O)O)O1)O)O
Computed Properties
- Hydrogen Bond Donor Count: 13
- Hydrogen Bond Acceptor Count: 23
- Heavy Atom Count: 62
- Rotatable Bond Count: 24
- Complexity: 1640
- Topological Polar Surface Area: 422
Experimental Properties
- PSA: 435.76000
- LogP: -1.28840
sarcinapterin Related Literature
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Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Byungho Lim,Jaewon Jin,Jin Yoo,Seung Yong Han,Kyeongyeol Kim,Sungah Kang,Nojin Park,Sang Moon Lee,Hae Jin Kim,Seung Uk Son Chem. Commun., 2014,50, 7723-7726
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Saeideh Mirfakhraei,Malak Hekmati,Fereshteh Hosseini Eshbala,Hojat Veisi New J. Chem., 2018,42, 1757-1761
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Amandine Altmayer-Henzien,Valérie Declerck,David J. Aitken,Ewen Lescop,Denis Merlet,Jonathan Farjon Org. Biomol. Chem., 2013,11, 7611-7615
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