(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylsulfanyl-butanoyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]hexanoic acid
Molecular Formula:
C46H81N17O8S
InChI: InChI=1/C46H81N17O8S/c1-72-25-19-35(61-39(65)34(18-11-24-56-46(53)54)58-38(64)30(50)13-10-23-55-45(51)52)42(68)59-33(16-5-8-21-48)41(67)63-37(26-28-27-57-31-14-3-2-12-29(28)31)43(69)60-32(15-4-7-20-47)40(66)62-36(44(70)71)17-6-9-22-49/h2-3,12,14,27,30,32-37,57H,4-11,13,15-26,47-50H2,1H3,(H,58,64)(H,59,68)(H,60,69)(H,61,65)(H,62,66)(H,63,67)(H,70,71)(H4,51,52,55)(H4,53,54,56)/t30-,32-,33-,34-,35-,36-,37-/m0/s1/f/h58-63,70H,51-54H2
InChIKey: InChIKey=OAORXIZUYWAVCY-HWKNRGSFDI
SMILES: CSCCC(C(=O)NC(CCCCN)C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)NC(CCCCN)C(=O)NC(CCCCN)C(=O)O)NC(=O)C(CCCN=C(N)N)NC(=O)C(CCCN=C(N)N)N
Names:
(2S)-6-amino-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]amino]-4-methylsulfanyl-butanoyl]amino]hexanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanoyl]amino]hexanoic acid
Registries:
PubChem CID 9898056
PubChem ID 14865800
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