(1R,9S,12S,15R,16E,18R,19R,21R,23S,24E,26E,28E,30S,32S,35R)-12-[(2R)-1-{(1S,3R,4R)-4-[2-({[(2,5-Dioxo-1-pyrrolidinyl)oxy]carbonyl}oxy)ethoxy]-3-methoxycyclohexyl}-2-propanyl]-1,18-dihydroxy-19,30-dime thoxy-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.0^4,9]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone

More details:

• Systematic name

  (1R,9S,12S,15R,16E,18R,19R,21R,23S,24E,26E,28E,30S,32S,35R)-12-[(2R)-1-{(1S,3R,4R)-4-[2-({[(2,5-Dioxo-1-pyrrolidinyl)oxy]carbonyl}oxy)ethoxy]-3-methoxycyclohexyl}-2-propanyl]-1,18-dihydroxy-19,30-dime thoxy-15,17,21,23,29,35-hexamethyl-11,36-dioxa-4-azatricyclo[30.3.1.0~4,9~]hexatriaconta-16,24,26,28-tetraene-2,3,10,14,20-pentone

• SMILES

  C[C@@H]1C=CC=CC=C(C)[C@H](C[C@@H]2CC[C@@H](C)[C@@](C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@@H](CC(=O)[C@H](C)C=C(C)[C@H]([C@H](C(=O)[C@H](C)C1)OC)O)[C@H](C)C[C@@H]4CC[C@H]([C@@H](C4)OC)OCCOC(=O)ON5C(=O)CCC5=O)(O)O2)OC C[C@@H]1CC[C@H]2C[C@@H](/C(=C/C=C/C=C/[C@H](C[C@H](C(=O)[C@@H]([C@@H](/C(=C/[C@H](C(=O)C[C@H](OC(=O)[C@@H]3CCCCN3C(=O)C(=O)[C@@]1(O2)O)[C@H](C)C[C@@H]4CC[C@H]([C@@H](C4)OC)OCCOC(=O)ON5C(=O)CCC5=O)C)/C)O)OC)C)C)/C)OC

• Std. InChi

  InChI=1S/C58H86N2O18/c1-34-16-12-11-13-17-35(2)46(71-8)32-42-21-19-40(7)58(70,77-42)54(66)55(67)59-25-15-14-18-43(59)56(68)76-47(33-44(61)36(3)29-39(6)52(65)53(73-10)51(64)38(5)28-34)37(4)30-41-20-22-45(48(31-41)72-9)74-26-27-75-57(69)78-60-49(62)23-24-50(60)63/h11-13,16-17,29,34,36-38,40-43,45-48,52-53,65,70H,14-15,18-28,30-33H2,1-10H3/b13-11+,16-12+,35-17+,39-29+/t34-,36-,37-,38-,40-,41+,42+,43+,45-,46+,47+,48-,52-,53+,58-/m1/s1

• Std. InChIKey

  VFMZATKQNDOTPM-CXJKJKOCSA-N

• Cite this record

  CSID:58785769, http://www.chemspider.com/Chemical-Structure.58785769.html (accessed 23:46, Jul 3, 2024)