ROX NHS ester, pure 6– isomer

cas: 117491-83-5 — see every product listed under this CAS number, including other names

ROX NHS ester, pure 6– isomer (CAS 117491-83-5) is a chemical reagent available from Chemat. Available pack sizes: 5mg, 25mg. Offered by: GLPBio.

brandGLPBio
catalog numberGC17097-5
cas117491-83-5
size5mg
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Available pack sizes

brand size price
GLPBio 5mg 1149.34 Pln
GLPBio 25mg 1860.77 Pln

properties

purityNo data
delivery timeTo be confirmed by Chemat
Structural formula: {0} (CAS {1})

(2,5-dioxopyrrolidin-1-yl) 1-oxospiro[2-benzofuran-3,16'-3-oxa-9,23-diazaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4(15),5(28),13,18-hexaene]-5-carboxylate (CAS 117491-83-5) is a chemical compound with the molecular formula C37H33N3O7 and a molecular weight of 631.7 g/mol. IUPAC name: (2,5-dioxopyrrolidin-1-yl) 1-oxospiro[2-benzofuran-3,16'-3-oxa-9,23-diazaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4(15),5(28),13,18-hexaene]-5-carboxylate. InChIKey: PLTIOQHKDXDXSK-UHFFFAOYSA-N.

Identity
Molecular formulaC37H33N3O7
Molecular weight631.7 g/mol
IUPAC name(2,5-dioxopyrrolidin-1-yl) 1-oxospiro[2-benzofuran-3,16'-3-oxa-9,23-diazaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4(15),5(28),13,18-hexaene]-5-carboxylate
InChIKeyPLTIOQHKDXDXSK-UHFFFAOYSA-N
SMILESC1CC2=CC3=C(C4=C2N(C1)CCC4)OC5=C(C36C7=C(C=CC(=C7)C(=O)ON8C(=O)CCC8=O)C(=O)O6)C=C9CCCN1C9=C5CCC1

Computed by PubChem (NCBI)

Synonyms: ROX NHS ester, 6-isomer, orb2565341
Isomers (same molecular formula)
(2,5-dioxopyrrolidin-1-yl) 3-oxospiro[2-benzofuran-1,16'-3-oxa-9,23-diazaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4(15),5(28),13,18-hexaene]-5-carboxylate C37H33N3O7
5-(2,5-dioxopyrrolidin-1-yl)oxycarbonyl-2-(3-oxa-23-aza-9-azoniaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4,9(28),13,15,18-heptaen-16-yl)benzoate C37H33N3O7
4-(2,5-dioxopyrrolidin-1-yl)oxycarbonyl-2-(3-oxa-23-aza-9-azoniaheptacyclo[17.7.1.15,9.02,17.04,15.023,27.013,28]octacosa-1(27),2(17),4,9(28),13,15,18-heptaen-16-yl)benzoate C37H33N3O7

Also listed as

ROX NHS ester, 6-isomer MedChemExpress CAS 117491-83-5
ROX NHS ester, 6– isomer GLPBio CAS 117491-83-5, 1890922-83-4, 216699-36-4
ROX NHS ester, 6- isomer, 95% Lumiprobe CAS 117491-83-5, 1890922-83-4, 216699-36-4