Aklkvvaatyvlkk

Structural Information

Molecular Formula

C₇₃H₁₃₀N₁₈O₁₇

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

InChI

InChI=1S/C73H130N18O17/c1-38(2)35-53(85-64(98)49(23-15-19-31-74)81-60(94)43(11)78)66(100)83-51(25-17-21-33-76)65(99)88-58(42(9)10)71(105)90-56(40(5)6)69(103)80-44(12)61(95)79-45(13)62(96)91-59(46(14)92)72(106)87-55(37-47-27-29-48(93)30-28-47)68(102)89-57(41(7)8)70(104)86-54(36-39(3)4)67(101)82-50(24-16-20-32-75)63(97)84-52(73(107)108)26-18-22-34-77/h27-30,38-46,49-59,92-93H,15-26,31-37,74-78H2,1-14H3,(H,79,95)(H,80,103)(H,81,94)(H,82,101)(H,83,100)(H,84,97)(H,85,98)(H,86,104)(H,87,106)(H,88,99)(H,89,102)(H,90,105)(H,91,96)(H,107,108)/t43-,44-,45-,46+,49-,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-/m0/s1

InChIKey

UENAPXQRIHKCLI-ZVRJXTDWSA-N

Compound name

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

Related CIDs

• CID 16072955