Vitas-M small molecule compound

8-[4-(2-hydroxyethyl)piperazin-1-yl]-9-pentofuranosyl-1,9-dihydro-6H-purin-6-one

Catalog ID
STK370029
SMILES OCCN1CCN(CC1)c1nc2c(n1C1OC(C(C1O)O)CO)nc[nH]c2=O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H24N6O6 MW 396.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24N6O6/c23-6-5-20-1-3-21(4-2-20)16-19-10-13(17-8-18-14(10)27)22(16)15-12(26)11(25)9(7-24)28-15/h8-9,11-12,15,23-26H,1-7H2,(H,17,18,27)
InChIKey
NSJDMSBFUJXXCX-UHFFFAOYSA-N
Synonyms

8(4(2hydroxyethyl)piperazin1yl)9pentofuranosyl19dihydro6Hpurin6one
9((2R3R4S5R)34dihydroxy5(hydroxymethyl)tetrahydrofuran2yl)8(4(2hydroxyethyl)piperazin1yl)1Hpurin6(9H)one
9(34DIHYDROXY5(HYDROXYMETHYL)OXOLAN2YL)8(4(2HYDROXYETHYL)PIPERAZIN1YL)3HPURIN6ONE
9(34DIHYDROXY5(HYDROXYMETHYL)OXOLAN2YL)8(4(2HYDROXYETHYL)PIPERAZINYL)HYDROPURIN6ONE
C1CN(CCN1CCO)C2=NC3=C(N2C4C(C(C(O4)CO)O)O)NC=NC3=O
InChI=1SC16H24N6O6c2365201321(4220)16191013(1781814(10)27)22(16)1512(26)11(25)9(724)2815h891112152326H17H2(H171827)
MFCD00333843
OCCN1CCN(CC1)c1nc2c(n1(C@@H)1O(C@@H)((C@H)((C@H)1O)O)CO)nc(nH)c2=O
OCCN1CCN(CC1)c1nc2c(n1C1OC(C(C1O)O)CO)nc(nH)c2=O
ZINC000013306048

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Available files

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