Adlevvaatyvdvd

Structural Information

Molecular Formula

C₆₅H₁₀₂N₁₄O₂₅

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(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(=O)O)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/C65H102N14O25/c1-26(2)21-38(71-57(95)40(23-44(84)85)70-52(90)31(11)66)56(94)69-37(19-20-43(82)83)55(93)75-50(30(9)10)63(101)78-47(27(3)4)60(98)68-32(12)53(91)67-33(13)54(92)79-51(34(14)80)64(102)72-39(22-35-15-17-36(81)18-16-35)58(96)76-48(28(5)6)61(99)73-41(24-45(86)87)59(97)77-49(29(7)8)62(100)74-42(65(103)104)25-46(88)89/h15-18,26-34,37-42,47-51,80-81H,19-25,66H2,1-14H3,(H,67,91)(H,68,98)(H,69,94)(H,70,90)(H,71,95)(H,72,102)(H,73,99)(H,74,100)(H,75,93)(H,76,96)(H,77,97)(H,78,101)(H,79,92)(H,82,83)(H,84,85)(H,86,87)(H,88,89)(H,103,104)/t31-,32-,33-,34+,37-,38-,39-,40-,41-,42-,47-,48-,49-,50-,51-/m0/s1

InChIKey

WOVSDBXFQLFFAU-JSNNEWDNSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-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]-3-carboxypropanoyl]amino]-3-methylbutanoyl]amino]butanedioic acid

Related CIDs

• CID 16186474