Lepista nuda protease

Structural Information

Molecular Formula

C₇₁H₁₁₂N₁₆O₂₂

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@@H](C)O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(=O)N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)O)NC(=O)[C@H](C)N)O

InChI

InChI=1S/C71H112N16O22/c1-31(2)26-45(60(97)77-47(28-43-22-18-16-19-23-43)63(100)86-53(39(12)89)67(104)76-37(10)71(108)109)79-70(107)56(42(15)92)87-64(101)49(30-50(73)93)81-69(106)55(41(14)91)84-59(96)36(9)74-58(95)35(8)75-66(103)52(38(11)88)85-61(98)46(27-32(3)4)78-65(102)51(33(5)6)82-62(99)48(29-44-24-20-17-21-25-44)80-68(105)54(40(13)90)83-57(94)34(7)72/h16-25,31-42,45-49,51-56,88-92H,26-30,72H2,1-15H3,(H2,73,93)(H,74,95)(H,75,103)(H,76,104)(H,77,97)(H,78,102)(H,79,107)(H,80,105)(H,81,106)(H,82,99)(H,83,94)(H,84,96)(H,85,98)(H,86,100)(H,87,101)(H,108,109)/t34-,35-,36-,37-,38+,39+,40+,41+,42+,45-,46-,47-,48-,49-,51-,52-,53-,54-,55-,56-/m0/s1

InChIKey

OYSKCDSXCXFOQE-HQRQMNJHSA-N

Compound name

(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-4-amino-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-aminopropanoyl]amino]-3-hydroxybutanoyl]amino]-3-phenylpropanoyl]amino]-3-methylbutanoyl]amino]-4-methylpentanoyl]amino]-3-hydroxybutanoyl]amino]propanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-4-oxobutanoyl]amino]-3-hydroxybutanoyl]amino]-4-methylpentanoyl]amino]-3-phenylpropanoyl]amino]-3-hydroxybutanoyl]amino]propanoic acid

Related CIDs

• CID 71590627