Sqvffetf

Structural Information

Molecular Formula

C₄₉H₆₅N₉O₁₄

SMILES

C[C@H]([C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CO)N)O

InChI

InChI=1S/C49H65N9O14/c1-27(2)40(57-43(65)33(19-21-38(51)61)52-42(64)32(50)26-59)47(69)55-36(24-30-15-9-5-10-16-30)46(68)54-35(23-29-13-7-4-8-14-29)45(67)53-34(20-22-39(62)63)44(66)58-41(28(3)60)48(70)56-37(49(71)72)25-31-17-11-6-12-18-31/h4-18,27-28,32-37,40-41,59-60H,19-26,50H2,1-3H3,(H2,51,61)(H,52,64)(H,53,67)(H,54,68)(H,55,69)(H,56,70)(H,57,65)(H,58,66)(H,62,63)(H,71,72)/t28-,32+,33+,34+,35+,36+,37+,40+,41+/m1/s1

InChIKey

GEEWELBKRIYJLD-LLBXCXODSA-N

Compound name

(4S)-4-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-5-oxopentanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-5-[[(2S,3R)-1-[[(1S)-1-carboxy-2-phenylethyl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-5-oxopentanoic acid

Related CIDs

• CID 476754