Adlevvaatyvkkk

Structural Information

Molecular Formula

C₇₀H₁₁₉N₁₇O₂₁

SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)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/C70H119N17O21/c1-34(2)31-48(82-64(101)50(33-52(92)93)81-57(94)38(9)74)63(100)78-46(26-27-51(90)91)62(99)84-55(37(7)8)68(105)86-53(35(3)4)66(103)76-39(10)58(95)75-40(11)59(96)87-56(41(12)88)69(106)83-49(32-42-22-24-43(89)25-23-42)65(102)85-54(36(5)6)67(104)79-45(20-14-17-29-72)60(97)77-44(19-13-16-28-71)61(98)80-47(70(107)108)21-15-18-30-73/h22-25,34-41,44-50,53-56,88-89H,13-21,26-33,71-74H2,1-12H3,(H,75,95)(H,76,103)(H,77,97)(H,78,100)(H,79,104)(H,80,98)(H,81,94)(H,82,101)(H,83,106)(H,84,99)(H,85,102)(H,86,105)(H,87,96)(H,90,91)(H,92,93)(H,107,108)/t38-,39-,40-,41+,44-,45-,46-,47-,48-,49-,50-,53-,54-,55-,56-/m0/s1

InChIKey

OZUWKFPHLMFKKY-RKALNYMBSA-N

Compound name

(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-aminopropanoyl]amino]-3-carboxypropanoyl]amino]-4-methylpentanoyl]amino]-4-carboxybutanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-methylbutanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoic acid

Related CIDs

• CID 16072961