U02
[2-(3-{[6-(1-BENZYL-PROPYL)-4-HYDROXY-2-OXO-2H-PYRAN-3-YL]-CYCLOPROPYL-METHYL}-PHENYLCARBAMOYL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER
Find entries where: U02
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
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Name | [2-(3-{[6-(1-BENZYL-PROPYL)-4-HYDROXY-2-OXO-2H-PYRAN-3-YL]-CYCLOPROPYL-METHYL}-PHENYLCARBAMOYL)-ETHYL]-CARBAMIC ACID TERT-BUTYL ESTER |
Identifiers | tert-butyl N-[3-[[3-[(S)-1-cycloprop-2-enyl-[4-hydroxy-2-oxo-6-[(2R)-1-phenylbutan-2-yl]pyran-3-yl]methyl]phenyl]amino]-3-oxo-propyl]carbamate |
Formula | C33 H38 N2 O6 |
Molecular Weight | 558.665 |
Type | NON-POLYMER |
Isomeric SMILES | CC[C@H](Cc1ccccc1)C2=CC(=C(C(=O)O2)[C@H](c3cccc(c3)NC(=O)CCNC(=O)OC(C)(C)C)C4C=C4)O |
InChI | InChI=1S/C33H38N2O6/c1-5-22(18-21-10-7-6-8-11-21)27-20-26(36)30(31(38)40-27)29(23-14-15-23)24-12-9-13-25(19-24)35-28(37)16-17-34-32(39)41-33(2,3)4/h6-15,19-20,22-23,29,36H,5,16-18H2,1-4H3,(H,34,39)(H,35,37)/t22-,29+/m1/s1 |
InChIKey | OORLDLMDGJZAFM-MNNSJKJDSA-N |
Chemical Details | |
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Formal Charge | 0 |
Atom Count | 79 |
Chiral Atom Count | 2 |
Bond Count | 82 |
Aromatic Bond Count | 18 |
Related Resource References
Resource Name | Reference |
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PubChem | 54708751 |
ChEBI | CHEBI:46238 |