Ksrvlaiams

Structural Information

Molecular Formula

C₄₆H₈₆N₁₄O₁₃S

SMILES

CC[C@H](C)[C@@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CO)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)N

InChI

InChI=1S/C46H86N14O13S/c1-10-25(6)35(44(71)53-26(7)36(63)54-30(16-19-74-9)39(66)58-33(22-62)45(72)73)60-37(64)27(8)52-41(68)31(20-23(2)3)56-43(70)34(24(4)5)59-40(67)29(15-13-18-51-46(49)50)55-42(69)32(21-61)57-38(65)28(48)14-11-12-17-47/h23-35,61-62H,10-22,47-48H2,1-9H3,(H,52,68)(H,53,71)(H,54,63)(H,55,69)(H,56,70)(H,57,65)(H,58,66)(H,59,67)(H,60,64)(H,72,73)(H4,49,50,51)/t25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35-/m0/s1

InChIKey

PPQUWVCINYNXKD-ULPCFHQZSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-3-hydroxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-3-methylpentanoyl]amino]propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-3-hydroxypropanoic acid

Related CIDs

• CID 5481547