PRD_000894

MM-102

PRD_000894 is described in the Biologically Interesting Molecule Reference Dictionary (BIRD).

The representative PDB ID is 4GM8.

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Chemical Component Summary
Name	MM-102
Identifiers	[azanyl-[[(4S)-5-[[1-[bis(4-fluorophenyl)methylcarbamoyl]cyclopentyl]amino]-4-[[2-ethyl-2-(2-methylpropanoylamino)butanoyl]amino]-5-oxidanylidene-pentyl]amino]methylidene]azanium
Formula	C₃₅ H₅₀ F₂ N₇ O₄
Molecular Weight	670.813
Type	PEPTIDE-LIKE
Isomeric SMILES	CCC(CC)(C(=O)N[C@@H](CCCNC(=[NH2+])N)C(=O)NC1(CCCC1)C(=O)NC(c2ccc(cc2)F)c3ccc(cc3)F)NC(=O)C(C)C
InChI	InChI=1S/C35H49F2N7O4/c1-5-34(6-2,43-29(45)22(3)4)31(47)41-27(10-9-21-40-33(38)39)30(46)44-35(19-7-8-20-35)32(48)42-28(23-11-15-25(36)16-12-23)24-13-17-26(37)18-14-24/h11-18,22,27-28H,5-10,19-21H2,1-4H3,(H,41,47)(H,42,48)(H,43,45)(H,44,46)(H4,38,39,40)/p+1/t27-/m1/s1
InChIKey	RZKSQRIPRKWVBU-HHHXNRCGSA-O
Composition	Polymer Sequences: ALQ-0XL-ARG-AC5-0XN
BIRD class	INHIBITOR
Represented As	POLYMER
Compound Details	n/a
Description	n/a

Chemical Details
Formal Charge	0
Atom Count	98
Chiral Atom Count	1
Bond Count	100
Aromatic Bond Count	12

RCSB PDB Core Operations are funded by the National Science Foundation (DBI-1832184), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM133198.