(1'R,2S,4'S,5S,6R,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-6-[(2S)-2-Butanyl]-21',24'-dihydroxy-5,11',13',22'-tetramethyl-2'-oxo-5,6-dihydrospiro[pyran-2,6'-[3,7,19]trioxatetracyclo[15.6.1.1^4,8. 0^20,24]pentacosa[10,14,16,22]tetraen]-12'-yl 2,6-dideoxy-3-O-methyl-4-O-[2,4,6-trideoxy-4-(ethylamino)-3-O-methyl-α-D-lyxo-hexopyranosyl]-α-L-arabino-hexopyranoside

More details:

• Systematic name

  (1'R,2S,4'S,5S,6R,8'R,10'E,12'S,13'S,14'E,16'E,20'R,21'R,24'S)-6-[(2S)-2-Butanyl]-21',24'-dihydroxy-5,11',13',22'-tetramethyl-2'-oxo-5,6-dihydrospiro[pyran-2,6'-[3,7,19]trioxatetracyclo[15.6.1.1~4,8~. 0~20,24~]pentacosa[10,14,16,22]tetraen]-12'-yl 2,6-dideoxy-3-O-methyl-4-O-[2,4,6-trideoxy-4-(ethylamino)-3-O-methyl-alpha-D-lyxo-hexopyranosyl]-alpha-L-arabino-hexopyranoside

• SMILES

  O=C5O[C@H]2C[C@H](O[C@]/1(O[C@H]([C@@H](C)CC)[C@H](\C=C\1)C)C2)C/C=C(\C)[C@@H](O[C@@H]4O[C@@H](C)[C@H](O[C@H]3O[C@H](C)[C@H](NCC)[C@H](OC)C3)[C@@H](OC)C4)[C@H](/C=C/C=C6/[C@@]7(O)[C@H]5/C=C(/C)[C@@H](O)[C@H]7OC6)C

• Std. InChi

  InChI=1S/C50H77NO13/c1-12-27(3)45-30(6)19-20-49(64-45)25-36-22-35(63-49)18-17-29(5)44(28(4)15-14-16-34-26-57-47-43(52)31(7)21-37(48(53)60-36)50(34,47)54)61-41-24-39(56-11)46(33(9)59-41)62-40-23-38(55-10)42(51-13-2)32(8)58-40/h14-17,19-21,27-28,30,32-33,35-47,51-52,54H,12-13,18,22-26H2,1-11H3/b15-14+,29-17+,34-16+/t27-,28-,30-,32+,33-,35+,36-,37-,38+,39-,40+,41-,42-,43+,44-,45+,46-,47+,49+,50+/m0/s1

• Std. InChIKey

  PMVHUDKSWMWBSF-OCEMLHMFSA-N

• Cite this record

  CSID:8345494, http://www.chemspider.com/Chemical-Structure.8345494.html (accessed 07:01, May 29, 2024)