Products 1029890-89-8

CAS 1029890-89-8 appears in our catalog under these names: 1-((4R,5R)-4,5-Dihydroxy-L-ornithine)-Echinocandin B HCl, 1-((4R,5R)-4,5-Dihydroxy-L-ornithine)-Echinocandin B Hydrochloride, >95% (HPLC), ECBN HCL/ 99.17% (existing batch purity), 1–((4R,5R)–4,5–Dihydroxy–L–ornithine)echinocandin B hydrochloride (1:1), ECBN hydrochloride. Offered by: Chemat Brand, TRC, TargetMol, GLPBio, Biosynth. Available pack sizes: on request, 100mg, 500mg, 50mg, 1mg, 5mg, 10mg, 25mg.

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

(3S,6S,9S,11R,15S,18S,20R,21R,24S,25S,26S)-18-amino-6-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-11,20,21,25-tetrahydroxy-3,15-bis[(1R)-1-hydroxyethyl]-26-methyl-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosane-2,5,8,14,17,23-hexone;hydrochloride (CAS 1029890-89-8) is a chemical compound with the molecular formula C34H52ClN7O15 and a molecular weight of 834.3 g/mol. IUPAC name: (3S,6S,9S,11R,15S,18S,20R,21R,24S,25S,26S)-18-amino-6-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-11,20,21,25-tetrahydroxy-3,15-bis[(1R)-1-hydroxyethyl]-26-methyl-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosane-2,5,8,14,17,23-hexone;hydrochloride. InChIKey: FKIXKMLIKIOEJP-WJXYPMDHSA-N.

Identity
Molecular formulaC34H52ClN7O15
Molecular weight834.3 g/mol
IUPAC name(3S,6S,9S,11R,15S,18S,20R,21R,24S,25S,26S)-18-amino-6-[(1S,2S)-1,2-dihydroxy-2-(4-hydroxyphenyl)ethyl]-11,20,21,25-tetrahydroxy-3,15-bis[(1R)-1-hydroxyethyl]-26-methyl-1,4,7,13,16,22-hexazatricyclo[22.3.0.09,13]heptacosane-2,5,8,14,17,23-hexone;hydrochloride
InChIKeyFKIXKMLIKIOEJP-WJXYPMDHSA-N
SMILESC[C@H]1CN2[C@@H]([C@H]1O)C(=O)N[C@@H]([C@@H](C[C@@H](C(=O)N[C@H](C(=O)N3C[C@@H](C[C@H]3C(=O)N[C@H](C(=O)N[C@H](C2=O)[C@@H](C)O)[C@@H]([C@H](C4=CC=C(C=C4)O)O)O)O)[C@@H](C)O)N)O)O.Cl

Computed by PubChem (NCBI)