Rggrlcycrrrfcvcvgr

Structural Information

Molecular Formula

C₈₈H₁₅₀N₃₆O₂₀S₄

SMILES

CC(C)C[C@@H](C(=O)N[C@@H](CS)C(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CS)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CS)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)CNC(=O)[C@H](CCCNC(=N)N)N

InChI

InChI=1S/C88H150N36O20S4/c1-44(2)34-56(116-69(130)51(19-11-29-103-84(92)93)111-64(127)38-108-63(126)37-109-68(129)50(89)18-10-28-102-83(90)91)73(134)119-60(41-146)77(138)118-58(36-48-24-26-49(125)27-25-48)75(136)120-59(40-145)76(137)115-53(21-13-31-105-86(96)97)71(132)113-52(20-12-30-104-85(94)95)70(131)114-54(22-14-32-106-87(98)99)72(133)117-57(35-47-16-8-7-9-17-47)74(135)121-61(42-147)78(139)124-67(46(5)6)81(142)122-62(43-148)79(140)123-66(45(3)4)80(141)110-39-65(128)112-55(82(143)144)23-15-33-107-88(100)101/h7-9,16-17,24-27,44-46,50-62,66-67,125,145-148H,10-15,18-23,28-43,89H2,1-6H3,(H,108,126)(H,109,129)(H,110,141)(H,111,127)(H,112,128)(H,113,132)(H,114,131)(H,115,137)(H,116,130)(H,117,133)(H,118,138)(H,119,134)(H,120,136)(H,121,135)(H,122,142)(H,123,140)(H,124,139)(H,143,144)(H4,90,91,102)(H4,92,93,103)(H4,94,95,104)(H4,96,97,105)(H4,98,99,106)(H4,100,101,107)/t50-,51-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-,62-,66-,67-/m0/s1

InChIKey

XVVTWELITATBSB-UEDJBKKJSA-N

Compound name

(2S)-2-[[2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-5-carbamimidamidopentanoyl]amino]acetyl]amino]acetyl]amino]-5-carbamimidamidopentanoyl]amino]-4-methylpentanoyl]amino]-3-sulfanylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-sulfanylpropanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-3-phenylpropanoyl]amino]-3-sulfanylpropanoyl]amino]-3-methylbutanoyl]amino]-3-sulfanylpropanoyl]amino]-3-methylbutanoyl]amino]acetyl]amino]-5-carbamimidamidopentanoic acid

Related CIDs

• CID 16136437