Synonym
Jmv 236; Jmv-236; Jmv236; t-Boc(nle(28,31))-cck (26-33);
IUPAC/Chemical Name
(3S,6S,9S,15S,18S,21S)-9-((1H-indol-3-yl)methyl)-21-amino-3-(((S)-1-amino-1-oxo-3-phenylpropan-2-yl)carbamoyl)-19-(tert-butoxycarbonyl)-6,15-dibutyl-5,8,11,14,17,20-hexaoxo-18-(4-(sulfooxy)benzyl)-4,7,10,13,16,19-hexaazatricosanedioic acid
InChi Key
MVTSFWYNRALKOI-JBNHEJHRSA-N
InChi Code
InChI=1S/C56H74N10O18S/c1-6-8-18-39(63-53(77)44(26-33-21-23-35(24-22-33)84-85(80,81)82)66(55(79)83-56(3,4)5)54(78)37(57)28-46(68)69)49(73)60-31-45(67)61-42(27-34-30-59-38-20-14-13-17-36(34)38)51(75)62-40(19-9-7-2)50(74)65-43(29-47(70)71)52(76)64-41(48(58)72)25-32-15-11-10-12-16-32/h10-17,20-24,30,37,39-44,59H,6-9,18-19,25-29,31,57H2,1-5H3,(H2,58,72)(H,60,73)(H,61,67)(H,62,75)(H,63,77)(H,64,76)(H,65,74)(H,68,69)(H,70,71)(H,80,81,82)/t37-,39-,40-,41-,42-,43-,44-/m0/s1
SMILES Code
O=C(N)[C@H](CC1=CC=CC=C1)NC([C@H](CC(O)=O)NC([C@H](CCCC)NC([C@H](CC2=CNC3=C2C=CC=C3)NC(CNC([C@H](CCCC)NC([C@H](CC4=CC=C(OS(=O)(O)=O)C=C4)N(C([C@H](CC(O)=O)N)=O)C(OC(C)(C)C)=O)=O)=O)=O)=O)=O)=O
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
>3 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
2934.99.03.00
