Halovir K

AlkaPlorer ID: AK328440

Synonym: None

IUPAC Name: [(2S)-2-[[(2S)-5-amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-1-[2-(dodecanoylamino)-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-5-oxopentanoyl]amino]-4-methylpentyl] acetate

Structure

SMILES: CCCCCCCCCCCC(=O)NC(C)(C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](COC(C)=O)CC(C)C

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InChI: InChI=1S/C43H77N7O9/c1-10-11-12-13-14-15-16-17-18-21-37(53)49-43(8,9)42(58)50-24-19-20-35(50)41(57)48-34(26-29(4)5)40(56)45-30(6)38(54)47-33(22-23-36(44)52)39(55)46-32(25-28(2)3)27-59-31(7)51/h28-30,32-35H,10-27H2,1-9H3,(H2,44,52)(H,45,56)(H,46,55)(H,47,54)(H,48,57)(H,49,53)/t30-,32-,33-,34-,35-/m0/s1

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InChIKey: OWRFSPPPFYZQSO-BLRSMAGHSA-N

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Source

Properties Information

Molecule Weight: 836.1289999999998

TPSA: 235.2

MolLogP: 3.67300000000001

Number of H-Donors: 6

Number of H-Acceptors: 9

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information