(2Z,2'Z,4E,4'S,7R,8E,12R,16R)-2'-hydroxyimino-7-(methoxymethoxy)-4',9,16-trimethyl-4'-oxidanyl-spiro[18-thia-15,20-diazabicyclo[15.2.1]icosa-1(19),2,4,8,17(20)-pentaene-12,5'-thiolane]-3',6,14-trione

Systemtic Name: (2Z,2'Z,4E,4'S,7R,8E,12R,16R)-2'-hydroxyimino-7-(methoxymethoxy)-4',9,16-trimethyl-4'-oxidanyl-spiro[18-thia-15,20-diazabicyclo[15.2.1]icosa-1(19),2,4,8,17(20)-pentaene-12,5'-thiolane]-3',6,14-trione Openeye Name: (2Z,2'Z,4E,4'S,7R,8E,12R,16R)-4'-hydroxy-2'-hydroxyimino-7-(methoxymethoxy)-4',9,16-trimethyl-spiro[18-thia-15,20-diazabicyclo[15.2.1]icosa-1(19),2,4,8,17(20)-pentaene-12,5'-tetrahydrothiophene]-3',6,14-trione CAS Name: (2Z,2'Z,4E,4'S,7R,8E,12R,16R)-4'-hydroxy-2'-hydroxyimino-7-(methoxymethoxy)-4',9,16-trimethylspiro[18-thia-15,20-diazabicyclo[15.2.1]eicosa-1(19),2,4,8,17(20)-pentaene-12,5'-thiolane]-3',6,14-trione IUPAC Name: (2Z,2'Z,4E,4'S,7R,8E,12R,16R)-4'-hydroxy-2'-hydroxyimino-7-(methoxymethoxy)-4',9,16-trimethylspiro[18-thia-15,20-diazabicyclo[15.2.1]icosa-1(19),2,4,8,17(20)-pentaene-12,5'-thiolane]-3',6,14-trione Traditional Name: (2Z,2'Z,4E,4'S,7R,8E,12R,16R)-2'-hydroximino-4'-hydroxy-7-(methoxymethoxy)-4',9,16-trimethyl-spiro[18-thia-15,20-diazabicyclo[15.2.1]eicosa-1(19),2,4,8,17(20)-pentaene-12,5'-tetrahydrothiophene]-3',6,14-trione Formula: C25H31N3O7S2 MolecularWeight: 549.65954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C2=NC(=CS2)C=CC=CC(=O)C(C=C(CCC3(CC(=O)N1)C(C(=O)C(=NO)S3)(C)O)C)OCOC

Isomeric SMILES

C[C@@H]1C2=NC(=CS2)/C=C\C=C\C(=O)[C@@H](/C=C(/CC[C@@]3(CC(=O)N1)[C@@](C(=O)/C(=N/O)/S3)(C)O)\C)OCOC

InChI

InChI=1S/C25H31N3O7S2/c1-15-9-10-25(24(3,32)21(31)23(28-33)37-25)12-20(30)26-16(2)22-27-17(13-36-22)7-5-6-8-18(29)19(11-15)35-14-34-4/h5-8,11,13,16,19,32-33H,9-10,12,14H2,1-4H3,(H,26,30)/b7-5-,8-6+,15-11+,28-23-/t16-,19-,24+,25-/m1/s1