Adlevvaatfvlva

Structural Information

Molecular Formula

C₆₆H₁₀₈N₁₄O₂₀

SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](C)N)O

InChI

InChI=1S/C66H108N14O20/c1-29(2)25-42(73-58(91)45(28-47(84)85)72-53(86)35(13)67)57(90)71-41(23-24-46(82)83)56(89)76-51(34(11)12)64(97)79-49(32(7)8)61(94)69-36(14)54(87)68-37(15)55(88)80-52(39(17)81)65(98)75-44(27-40-21-19-18-20-22-40)60(93)78-50(33(9)10)63(96)74-43(26-30(3)4)59(92)77-48(31(5)6)62(95)70-38(16)66(99)100/h18-22,29-39,41-45,48-52,81H,23-28,67H2,1-17H3,(H,68,87)(H,69,94)(H,70,95)(H,71,90)(H,72,86)(H,73,91)(H,74,96)(H,75,98)(H,76,89)(H,77,92)(H,78,93)(H,79,97)(H,80,88)(H,82,83)(H,84,85)(H,99,100)/t35-,36-,37-,38-,39+,41-,42-,43-,44-,45-,48-,49-,50-,51-,52-/m0/s1

InChIKey

BFERZLGFNKNXDO-HZUCVSECSA-N

Compound name

(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-carboxypropanoyl]amino]-4-methylpentanoyl]amino]-5-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(1S)-1-carboxyethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid

Related CIDs

• CID 16072936