Vitas-M small molecule compound
8-(heptylsulfanyl)-7-hexadecyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK528864
SMILES CCCCCCCCCCCCCCCCn1c(SCCCCCCC)nc2c1c(=O)[nH]c(=O)n2C
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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 C29H52N4O2S MW 520.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H52N4O2S/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-21-23-33-25-26(32(3)28(35)31-27(25)34)30-29(33)36-24-22-20-9-7-5-2/h4-24H2,1-3H3,(H,31,34,35)InChIKey
YRRVZTCQTDAWQK-UHFFFAOYSA-NSynonyms
369608-65-1369608651
8(heptylsulfanyl)7hexadecyl3methyl37dihydro1Hpurine26dione
8(heptylthio)7hexadecyl3methyl1Hpurine26(3H7H)dione
8HEPTYLSULFANYL7HEXADECYL3METHYL37DIHYDROPURINE26DIONE
8HEPTYLSULFANYL7HEXADECYL3METHYLPURINE26DIONE
8HEPTYLTHIO7HEXADECYL3METHYL137TRIHYDROPURINE26DIONE
CCCCCCCCCCCCCCCCn1c(SCCCCCCC)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCCCCCCCCCCCN1C2=C(N=C1SCCCCCCC)N(C(=O)NC2=O)C
InChI=1SC29H52N4O2Sc1468101112131415161718192123332526(32(3)28(35)3127(25)34)3029(33)362422209752h424H213H3(H313435)
MFCD01017642
ZINC000008398550
ZINC8398550
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