Synonym
KS-133; KS 133; KS 133;
IUPAC/Chemical Name
(6R,11R,14R,22S,24aR,30S,33S,35aS,40aS,43S,46S)-6-acetamido-N-((S)-1-(((2R,3R)-1-amino-3-methyl-1-oxopentan-2-yl)amino)-4-methyl-1-oxopentan-2-yl)-33,43-bis(4-hydroxybenzyl)-30,46-diisobutyl-5,12,16,24,29,32,35,40,41,44,47-undecaoxotetratriacontahydro-1H,5H,10H,29H-11,22-(epiminoethanoiminoethanoiminomethano)tripyrrolo[1,2-f:1',2'-i:1'',2''-r][1,2]dithia[6,9,12,15,18,21,27,31]octaazacyclotetratriacontine-14-carboxamide
InChi Key
FCYHSMMFZBVBRY-DANBRWBZSA-N
InChi Code
InChI=1S/C75H111N15O17S2/c1-10-43(8)62(63(76)95)87-69(101)51(33-41(4)5)81-68(100)54-37-61(94)77-28-12-11-16-49-64(96)82-52(35-45-20-24-47(92)25-21-45)66(98)80-50(32-40(2)3)65(97)86-56(70(102)83-54)38-108-109-39-57(78-44(9)91)74(106)90-31-15-19-60(90)75(107)89-30-14-18-59(89)72(104)84-53(36-46-22-26-48(93)27-23-46)67(99)85-55(34-42(6)7)73(105)88-29-13-17-58(88)71(103)79-49/h20-27,40-43,49-60,62,92-93H,10-19,28-39H2,1-9H3,(H2,76,95)(H,77,94)(H,78,91)(H,79,103)(H,80,98)(H,81,100)(H,82,96)(H,83,102)(H,84,104)(H,85,99)(H,86,97)(H,87,101)/t43-,49+,50+,51+,52+,53+,54-,55+,56+,57+,58-,59+,60+,62-/m1/s1
SMILES Code
OC1=CC=C(C[C@@H](C(N[C@H](C(N2[C@@H](C(N[C@@H](CCCCNC(C[C@H](C(N[C@@H](CC(C)C)C(N[C@@H](C(N)=O)[C@H](C)CC)=O)=O)NC3=O)=O)C(N[C@@H](CC4=CC=C(O)C=C4)C(N[C@H]5CC(C)C)=O)=O)=O)CCC2)=O)CC(C)C)=O)NC([C@H]6N(C([C@H]7N(C([C@H](CSSC[C@@H]3NC5=O)NC(C)=O)=O)CCC7)=O)CCC6)=O)C=C1
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
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
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