Summary

Molecular formula: C41H68N12O15S
SMILES: SCC(C(=O)NC(C(=O)NC(C(=O)N)[C@@H](O)C)[C@H](O)C)NC(=O)C([C@H](O)C)NC(=O)C1CCCN1C(=O)C(NC(=O)C1CCCN1C(=O)C1CCCN1C(=O)C(NC(=O)C([C@H](O)C)N)CC(=O)N)C
InChI: InChI=1S/C41H68N12O15S/c1-17(45-34(61)24-9-7-13-52(24)41(68)26-11-8-14-53(26)40(67)22(15-27(42)58)46-36(63)28(43)18(2)54)39(66)51-12-6-10-25(51)35(62)50-30(20(4)56)37(64)47-23(16-69)33(60)49-31(21(5)57)38(65)48-29(19(3)55)32(44)59/h17-26,28-31,54-57,69H,6-16,43H2,1-5H3,(H2,42,58)(H2,44,59)(H,45,61)(H,46,63)(H,47,64)(H,48,65)(H,49,60)(H,50,62)/t17?,18-,19+,20-,21-,22?,23?,24?,25?,26?,28?,29?,30?,31?/m1/s1
InChIKey: DDANCFZIEHSLSJ-XYMUKPEBSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C(NCC(=O)N1CCCC1)C1CCCN1C(=O)C1CCCN1

Scaffold Graph/Node level:
OC(NCC(O)N1CCCC1)C1CCCN1C(O)C1CCCN1

Scaffold Graph level:
CC(CCC(C)C1CCCC1C(C)C1CCCC1)C1CCCC1

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Chemical classification

Kingdom: Organic compounds
Super class: Organic Polymers
Class: Polypeptides

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Synonymous chemical names:
poh 3

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External chemical identifiers:
CID_139588371; NPATLAS_NPA018904; CHEMSPIDER_78445699

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Chemical structure download