cephalostatin 12

More details:

• Systematic name

  (1'S,2S,3R,3''R,3a'S,4b'R,5S,5''S,6a'S,9a'S,9b'S,11'R,11a'R,11b'S,12'S,13'S,14a'S,15b'R,17a'S,20a'S,20b'S,22'R,22a'R,22b'S)-5,5''-Bis(hydroxymethyl)-1',5,5'',9a',11a',12',20a',22a'-octamethyl-3a',4,4' ',4b',5,5',5'',6',6a',7',9',9a',9b',10',11',11a',14a',15b',16',17',17a',18',20',20a',20b',21',22',22a'-octacosahydro-3H,3''H-dispiro[furan-2,2'-bisfuro[3'',2'':3',4']cyclopenta[1',2':5,6]naphtho[1,2-b :1',2'-i]phenazine-13',2''-furan]-3,3'',11',11b',22',22b'(1'H,12'H)-hexol

• SMILES

  C[C@@H]1[C@]2([C@@H](C[C@@](O2)(C)CO)O)O[C@@H]3[C@]1([C@]4([C@@H](C[C@H]5[C@H](C4=C3)CC[C@@H]6[C@@]5(CC7=C(C6)N=C8C[C@]9([C@@H](CC[C@@H]1[C@@H]9C[C@H]([C@]2(C1=C[C@H]1[C@@]2([C@@H]([C@@]2(O1)[C@@H](C[C@@](O2)(C)CO)O)C)O)C)O)CC8=N7)C)C)O)C)O

• Std. InChi

  InChI=1S/C54H76N2O12/c1-25-51(63)43(65-53(25)41(61)21-45(3,23-57)67-53)17-33-29-11-9-27-13-35-37(19-47(27,5)31(29)15-39(59)49(33,51)7)55-36-14-28-10-12-30-32(48(28,6)20-38(36)56-35)16-40(60)50(8)34(30)18-44-52(50,64)26(2)54(66-44)42(62)22-46(4,24-58)68-54/h17-18,25-32,39-44,57-64H,9-16,19-24H2,1-8H3/t25-,26-,27-,28-,29+,30+,31-,32-,39+,40+,41+,42+,43-,44-,45-,46-,47-,48-,49+,50+,51+,52+,53-,54-/m0/s1

• Std. InChIKey

  NVRMDLWDRHEFNO-LGANMPMMSA-N

• Cite this record

  CSID:10476939, http://www.chemspider.com/Chemical-Structure.10476939.html (accessed 07:42, Jul 27, 2024)