Schembl29494597

Structural Information

Molecular Formula

C₈₄H₁₆₃N₃₅O₁₅

SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)N

InChI

InChI=1S/C84H163N35O15/c1-43(2)36-50(85)64(120)107-51(22-15-29-100-78(86)87)65(121)114-58(37-44(3)4)71(127)108-52(23-16-30-101-79(88)89)66(122)115-59(38-45(5)6)72(128)109-53(24-17-31-102-80(90)91)67(123)116-60(39-46(7)8)73(129)110-54(25-18-32-103-81(92)93)68(124)117-61(40-47(9)10)74(130)111-55(26-19-33-104-82(94)95)69(125)118-62(41-48(11)12)75(131)112-56(27-20-34-105-83(96)97)70(126)119-63(42-49(13)14)76(132)113-57(77(133)134)28-21-35-106-84(98)99/h43-63H,15-42,85H2,1-14H3,(H,107,120)(H,108,127)(H,109,128)(H,110,129)(H,111,130)(H,112,131)(H,113,132)(H,114,121)(H,115,122)(H,116,123)(H,117,124)(H,118,125)(H,119,126)(H,133,134)(H4,86,87,100)(H4,88,89,101)(H4,90,91,102)(H4,92,93,103)(H4,94,95,104)(H4,96,97,105)(H4,98,99,106)/t50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-/m0/s1

InChIKey

BPRJHNWDQITFOE-ZZADNGCVSA-N

Compound name

(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid

Related CIDs

• CID 25084027