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I14-40241 H-SER-ILE-ILE-ASN-PHE-GLU-LYS-LEU-OH (CAS# 138831-86-4)
General Information
Catalog No.:
I14-40241
Synonym:
Cas#:
138831-86-4
MDL# :
Molecular Formula:
C45H74N10O13
Mole Weight:
962.54
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Formula C45H74N10O13
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N([C@@H](Cc1ccccc1)C(=O)N[C@@H](C(=O)N[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)O)CCCCN)CCC(=O)O)C(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](CO)N)[C@@H](CC)C)[C@H](CC)C)CC(=O)N Mrv0541 06201309322D 68 68 0 0 0 0 999 V2000 0.7145 -11.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -11.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -10.7250 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7145 -11.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -9.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.7145 -9.4875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4289 -10.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1434 -9.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.1434 -8.6625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8579 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5724 -9.4875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -9.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7145 -8.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -9.9000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1434 -9.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1434 -8.6625 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8579 -8.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -8.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4289 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8579 -10.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5724 -9.4875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2868 -9.9000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2868 -10.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -11.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -10.7250 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -11.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -9.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0013 -8.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7158 -9.9000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4302 -9.4875 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.4302 -8.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 -8.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8592 -7.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5737 -7.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5737 -8.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8592 -8.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1447 -10.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8592 -9.4875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5737 -9.9000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.5737 -10.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2881 -11.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2881 -11.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5737 -12.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0026 -12.3750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2881 -9.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2881 -8.6625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0026 -9.9000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.7171 -9.4875 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.7171 -8.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4315 -8.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1460 -8.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8605 -8.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5749 -8.6625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4315 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4315 -10.7250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1460 -9.4875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.8605 -9.9000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.5749 -9.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2894 -9.9000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.0039 -9.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.2894 -10.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8605 -10.7250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1460 -11.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5749 -11.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 1 0 0 0 3 5 1 0 0 0 0 5 6 1 6 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 1 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 5 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 16 15 1 6 0 0 0 16 17 1 0 0 0 0 17 18 1 6 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 16 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 24 23 1 6 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 24 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 32 31 1 1 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 35 36 1 0 0 0 0 36 37 2 0 0 0 0 37 38 1 0 0 0 0 38 39 2 0 0 0 0 34 39 1 0 0 0 0 32 40 1 0 0 0 0 40 41 2 0 0 0 0 40 42 1 0 0 0 0 43 42 1 1 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 45 46 1 0 0 0 0 46 47 1 0 0 0 0 46 48 2 0 0 0 0 43 49 1 0 0 0 0 49 50 2 0 0 0 0 49 51 1 0 0 0 0 52 51 1 6 0 0 0 52 53 1 0 0 0 0 53 54 1 0 0 0 0 54 55 1 0 0 0 0 55 56 1 0 0 0 0 56 57 1 0 0 0 0 52 58 1 0 0 0 0 58 59 2 0 0 0 0 58 60 1 0 0 0 0 61 60 1 1 0 0 0 61 62 1 0 0 0 0 62 63 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 61 66 1 0 0 0 0 66 67 1 0 0 0 0 66 68 2 0 0 0 0 M END
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