D-cys-d-val-d-val-d-ile-d-val-gly-d-arg-d-ile-d-val-d-leu-d-ser-gly-d-lys

Structural Information

Molecular Formula

C₆₀H₁₁₁N₁₇O₁₅S

SMILES

CC[C@@H](C)[C@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCN=C(N)N)NC(=O)CNC(=O)[C@@H](C(C)C)NC(=O)[C@@H]([C@H](C)CC)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H](CS)N

InChI

InChI=1S/C60H111N17O15S/c1-15-34(13)47(57(89)75-44(31(7)8)54(86)70-39(24-29(3)4)52(84)71-40(27-78)50(82)66-25-42(80)69-38(59(91)92)20-17-18-22-61)76-51(83)37(21-19-23-65-60(63)64)68-41(79)26-67-53(85)43(30(5)6)73-58(90)48(35(14)16-2)77-56(88)46(33(11)12)74-55(87)45(32(9)10)72-49(81)36(62)28-93/h29-40,43-48,78,93H,15-28,61-62H2,1-14H3,(H,66,82)(H,67,85)(H,68,79)(H,69,80)(H,70,86)(H,71,84)(H,72,81)(H,73,90)(H,74,87)(H,75,89)(H,76,83)(H,77,88)(H,91,92)(H4,63,64,65)/t34-,35-,36-,37+,38+,39-,40+,43-,44+,45-,46-,47-,48-/m1/s1

InChIKey

VYJNKXXRIBVNPD-KCNOANAVSA-N

Compound name

(2S)-6-amino-2-[[2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2R,3R)-2-[[(2S)-2-[[2-[[(2R)-2-[[(2R,3R)-2-[[(2R)-2-[[(2R)-2-[[(2S)-2-amino-3-sulfanylpropanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]acetyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-3-methylpentanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]acetyl]amino]hexanoic acid

Related CIDs

• CID 492244