[(2R)-2-[[(2S)-2-[[(2S)-2,6-bis(azanyl)hexanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentyl] N-[(2R)-1-[[(2S)-6-azanyl-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-6-azanyl-1-[[(2R)-1-[[(2S)-1-[[(2S)-1,6-bis(azanyl)-1-oxidanylidene-hexan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylid

Systemtic Name: [(2R)-2-[[(2S)-2-[[(2S)-2,6-bis(azanyl)hexanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentyl] N-[(2R)-1-[[(2S)-6-azanyl-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-6-azanyl-1-[[(2R)-1-[[(2S)-1-[[(2S)-1,6-bis(azanyl)-1-oxidanylidene-hexan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylidene-hexan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-4-methyl-1-oxidanylidene-pentan-2-yl]amino]-1-oxidanylid Openeye Name: [(2R)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentyl] N-[(1R)-1-[[(1S)-5-amino-1-[[(1S)-1-[[(1S)-1-[[(1R)-1-[[(1S)-5-amino-1-[[(1R)-1-[[(1S)-1-[[(1S)-5-amino-1-carbamoyl-pentyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]pentyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]pentyl]carbamoyl]-3-methyl-butyl]carbamate CAS Name: N-[(2R)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-6-amino-1-[[(2R)-1-[[(2S)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamic acid [(2R)-2-[[(2S)-2-[[(2S)-2,6-diamino-1-oxohexyl]amino]-4-methyl-1-oxopentyl]amino]-4-methylpentyl] ester IUPAC Name: [(2R)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentyl] N-[(2R)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[(2R)-1-[[(2S)-6-amino-1-[[(2R)-1-[[(2S)-1-[[(2S)-1,6-diamino-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-[(1R)-1-[[(1S)-5-amino-1-[[(1S)-1-[[(1S)-1-[[(1R)-1-[[(1S)-5-amino-1-[[(1R)-1-[[(1S)-1-[[(1S)-5-amino-1-carbamoyl-pentyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]pentyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]-3-methyl-butyl]carbamoyl]pentyl]carbamoyl]-3-methyl-butyl]carbamic acid [(2R)-2-[[(2S)-2-[[(2S)-2,6-diaminohexanoyl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentyl] ester Formula: C73H141N17O13 MolecularWeight: 1465.00674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(COC(=O)NC(CC(C)C)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCCCN)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCCCN)C(=O)N)NC(=O)C(CC(C)C)NC(=O)C(CCCCN)N

Isomeric SMILES

CC(C)C[C@H](COC(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)N

InChI

InChI=1S/C73H141N17O13/c1-42(2)33-50(80-66(95)55(34-43(3)4)84-63(92)51(78)25-17-21-29-74)41-103-73(102)90-61(40-49(15)16)72(101)83-54(28-20-24-32-77)65(94)86-59(38-47(11)12)70(99)89-60(39-48(13)14)71(100)88-57(36-45(7)8)68(97)82-53(27-19-23-31-76)64(93)85-58(37-46(9)10)69(98)87-56(35-44(5)6)67(96)81-52(62(79)91)26-18-22-30-75/h42-61H,17-41,74-78H2,1-16H3,(H2,79,91)(H,80,95)(H,81,96)(H,82,97)(H,83,101)(H,84,92)(H,85,93)(H,86,94)(H,87,98)(H,88,100)(H,89,99)(H,90,102)/t50-,51+,52+,53+,54+,55+,56+,57-,58-,59+,60+,61-/m1/s1