Synonym
S 2613; S-2613; S2613; Boc-ile-glu-piperidyl-gly-arg-isoluminol;
IUPAC/Chemical Name
tert-butyl ((6S,12S,15S,16S)-1-amino-6-carbamoyl-7-(1,4-dioxo-1,2,3,4-tetrahydrophthalazin-6-yl)-1-imino-16-methyl-8,11,14-trioxo-12-(3-oxo-3-(piperidin-1-yl)propyl)-2,7,10,13-tetraazaoctadecan-15-yl)carbamate
InChi Key
QHEGQPRUIQIAGT-KXDOSHFCSA-N
InChi Code
InChI=1S/C37H57N11O9/c1-6-21(2)29(44-36(56)57-37(3,4)5)34(55)43-25(14-15-27(49)47-17-8-7-9-18-47)33(54)42-20-28(50)48(26(30(38)51)11-10-16-41-35(39)40)22-12-13-23-24(19-22)32(53)46-45-31(23)52/h12-13,19,21,25-26,29H,6-11,14-18,20H2,1-5H3,(H2,38,51)(H,42,54)(H,43,55)(H,44,56)(H,45,52)(H,46,53)(H4,39,40,41)/t21-,25-,26-,29-/m0/s1
SMILES Code
N=C(N)NCCC[C@@H](C(N)=O)N(C(CNC([C@H](CCC(N1CCCCC1)=O)NC([C@H]([C@@H](C)CC)NC(OC(C)(C)C)=O)=O)=O)=O)C2=CC3=C(C(NNC3=O)=O)C=C2
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
