R.i.ck-tat9

Structural Information

Molecular Formula

C₆₄H₁₂₆N₃₄O₁₃S

SMILES

CC(=O)N[C@H](CS)C(=O)N[C@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N

InChI

InChI=1S/C64H126N34O13S/c1-35(99)88-46(34-112)58(111)97-39(16-4-7-27-67)51(104)92-41(19-10-30-84-61(74)75)53(106)94-42(20-11-31-85-62(76)77)54(107)95-44(22-13-33-87-64(80)81)56(109)98-45(23-24-47(68)100)57(110)96-43(21-12-32-86-63(78)79)55(108)93-40(18-9-29-83-60(72)73)52(105)91-38(15-3-6-26-66)50(103)90-37(14-2-5-25-65)49(102)89-36(48(69)101)17-8-28-82-59(70)71/h36-46,112H,2-34,65-67H2,1H3,(H2,68,100)(H2,69,101)(H,88,99)(H,89,102)(H,90,103)(H,91,105)(H,92,104)(H,93,108)(H,94,106)(H,95,107)(H,96,110)(H,97,111)(H,98,109)(H4,70,71,82)(H4,72,73,83)(H4,74,75,84)(H4,76,77,85)(H4,78,79,86)(H4,80,81,87)/t36-,37-,38-,39+,40-,41-,42-,43-,44-,45-,46+/m0/s1

InChIKey

KUAFDLHRBPYTDI-XEDDXBNISA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-acetamido-3-sulfanylpropanoyl]amino]-6-aminohexanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-N-[(2S)-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-6-amino-1-[[(2S)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]pentanediamide

Related CIDs

• CID 25085919