5′-Guanidinonaltrindole Bis(trifluoroacetate) Salt
Product Code
TRC-G821700-50MG
CAS Number
Product Format
Neat
Molecular Formula
C27H29N5O3 • 2(C2HF3O2)
Molecular Weight
699.96
Product Categories
Alternate CAS Number
Product Information
Chemical Data
Analyte Name
5'-Guanidinonaltrindole Bis(trifluoroacetate) Salt
CAS Number
219655-57-9
Molecular Formula
C27H29N5O3 • 2(C2HF3O2)
Molecular Weight
699.96
Accurate Mass
699.21
SMILES
C(C(O)=O)(F)(F)F.O[C@]12[C@@]34C=5C(O[C@]3(C6=C(C1)C=7C(N6)=CC=C(NC(=N)N)C7)[H])=C(O)C=CC5C[C@]2(N(CC8CC8)CC4)[H]
InChI
InChI=1S/C27H29N5O3.C2HF3O2/c28-25(29)30-15-4-5-18-16(10-15)17-11-27(34)20-9-14-3-6-19(33)23-21(14)26(27,24(35-23)22(17)31-18)7-8-32(20)12-13-1-2-13;3-2(4,5)1(6)7/h3-6,10,13,20,24,31,33-34H,1-2,7-9,11-12H2,(H4,28,29,30);(H,6,7)/t20-,24+,26+,27-;/m1./s1
IUPAC
1-((4bS,8R,8aS,14bR)-7-(cyclopropylmethyl)-1,8a-dihydroxy-5,6,7,8,8a,9,14,14b-octahydro-4,8-methanobenzofuro[2,3-a]pyrido[4,3-b]carbazol-11-yl)guanidine 2,2,2-trifluoroacetate
Alternate CAS Number
Free Base: 219655-56-8
Product Data
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
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