Kkkkvvaatykkka

Structural Information

Molecular Formula

C₇₄H₁₃₅N₂₁O₁₇

SMILES

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

InChI

InChI=1S/C74H135N21O17/c1-42(2)58(94-72(109)59(43(3)4)93-69(106)56(29-15-22-40-81)90-67(104)54(27-13-20-38-79)88-65(102)52(25-11-18-36-77)86-63(100)50(82)23-9-16-34-75)71(108)84-44(5)61(98)83-45(6)62(99)95-60(47(8)96)73(110)92-57(41-48-30-32-49(97)33-31-48)70(107)91-55(28-14-21-39-80)68(105)89-53(26-12-19-37-78)66(103)87-51(24-10-17-35-76)64(101)85-46(7)74(111)112/h30-33,42-47,50-60,96-97H,9-29,34-41,75-82H2,1-8H3,(H,83,98)(H,84,108)(H,85,101)(H,86,100)(H,87,103)(H,88,102)(H,89,105)(H,90,104)(H,91,107)(H,92,110)(H,93,106)(H,94,109)(H,95,99)(H,111,112)/t44-,45-,46-,47+,50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-/m0/s1

InChIKey

JADYBNMGCGWZJL-JBQCYJJJSA-N

Compound name

(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2,6-diaminohexanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]propanoyl]amino]-3-hydroxybutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]hexanoyl]amino]hexanoyl]amino]hexanoyl]amino]propanoic acid

Related CIDs

• CID 16072952