Products 1689512-96-6

CAS 1689512-96-6 appears in our catalog under these names: 6–ROX hydrochloride, 6-ROX (hydrochloride), 98.01%, 6-ROX (hydrochloride), 99%, 99%. Offered by: GLPBio, MedChemExpress, Chemat. Available pack sizes: 10mg, 100mg, 50mg, 5 mg, 10 mg, 100 mg, 50 mg, 5mg.

6–ROX hydrochloride
GLPBio
  • size: 10mg, 100mg, 50mg
  • Variants: 3
from 1088.49
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6-ROX (hydrochloride), 98.01%
MedChemExpress
  • size: 5 mg, 10 mg, 100 mg, 50 mg
  • Variants: 4
from 575.11
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6-ROX (hydrochloride), 99%, 99%
Chemat
  • size: 5mg, 10mg, 50mg, 100mg
  • Variants: 4
from 1086.80
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Structural formula: {0} (CAS {1})

4-carboxy-3-(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;hydrochloride (CAS 1689512-96-6) is a chemical compound with the molecular formula C33H31ClN2O5 and a molecular weight of 571.1 g/mol. IUPAC name: 4-carboxy-3-(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;hydrochloride. InChIKey: HYKDMQKZQYLGAN-UHFFFAOYSA-N.

Identity
Molecular formulaC33H31ClN2O5
Molecular weight571.1 g/mol
IUPAC name4-carboxy-3-(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;hydrochloride
InChIKeyHYKDMQKZQYLGAN-UHFFFAOYSA-N
SMILESC1CC2=CC3=C(C4=C2N(C1)CCC4)OC5=C6CCC[N+]7=C6C(=CC5=C3C8=C(C=CC(=C8)C(=O)[O-])C(=O)O)CCC7.Cl

Computed by PubChem (NCBI)

Synonyms: 6-ROX (hydrochloride), 6-ROX hydrochloride