Pentixather

cas: 1339959-27-1 — see every product listed under this CAS number, including other names

Pentixather (CAS 1339959-27-1) is a chemical reagent available from Chemat. Available pack sizes: Get quote. Offered by: MedChemExpress.

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Structural formula: {0} (CAS {1})

2-[3-[(2S,5S,11R,14R)-14-(3-aminopropyl)-11-[(4-hydroxyphenyl)methyl]-13-methyl-5-(naphthalen-2-ylmethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]propyl]guanidine (CAS 1339959-27-1) is a chemical compound with the molecular formula C36H47N9O6 and a molecular weight of 701.8 g/mol. IUPAC name: 2-[3-[(2S,5S,11R,14R)-14-(3-aminopropyl)-11-[(4-hydroxyphenyl)methyl]-13-methyl-5-(naphthalen-2-ylmethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]propyl]guanidine. InChIKey: RYBIIIZNUPUDLJ-VZNYXHRGSA-N.

Identity
Molecular formulaC36H47N9O6
Molecular weight701.8 g/mol
IUPAC name2-[3-[(2S,5S,11R,14R)-14-(3-aminopropyl)-11-[(4-hydroxyphenyl)methyl]-13-methyl-5-(naphthalen-2-ylmethyl)-3,6,9,12,15-pentaoxo-1,4,7,10,13-pentazacyclopentadec-2-yl]propyl]guanidine
InChIKeyRYBIIIZNUPUDLJ-VZNYXHRGSA-N
SMILESCN1[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](C1=O)CC2=CC=C(C=C2)O)CC3=CC4=CC=CC=C4C=C3)CCCN=C(N)N)CCCN

Computed by PubChem (NCBI)

Synonyms: orb3180408

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