Synonym
Snf 8814; Snf-8814; Snf8814;
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)-15-benzyl-6-butyl-18-(1-(4-hydroxyphenyl)ethyl)-7-methyl-5,8,11,14,17,20-hexaoxo-4,7,10,13,16,19-hexaazatricosanedioic acid
InChi Key
KPCINFLGUVQMLR-NKOXCQSNSA-N
InChi Code
InChI=1S/C56H68N10O13/c1-4-5-20-45(54(77)63-43(29-48(71)72)53(76)62-41(50(58)73)25-33-14-8-6-9-15-33)66(3)56(79)44(27-36-30-59-40-19-13-12-18-38(36)40)61-46(68)31-60-52(75)42(26-34-16-10-7-11-17-34)64-55(78)49(65-51(74)39(57)28-47(69)70)32(2)35-21-23-37(67)24-22-35/h6-19,21-24,30,32,39,41-45,49,59,67H,4-5,20,25-29,31,57H2,1-3H3,(H2,58,73)(H,60,75)(H,61,68)(H,62,76)(H,63,77)(H,64,78)(H,65,74)(H,69,70)(H,71,72)/t32?,39-,41-,42-,43-,44-,45-,49-/m0/s1
SMILES Code
O=C(N)[C@H](CC1=CC=CC=C1)NC([C@H](CC(O)=O)NC([C@H](CCCC)N(C([C@H](CC2=CNC3=C2C=CC=C3)NC(CNC([C@H](CC4=CC=CC=C4)NC([C@H](C(C)C5=CC=C(O)C=C5)NC([C@H](CC(O)=O)N)=O)=O)=O)=O)=O)C)=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
