input word = C00023101

Metabolite InformationStructural formula
Name 3',4'-Epoxymonoanhydrobacterioruberin
Formula C50H74O4
Mw 738.55871085
CAS RN 165675-36-5
C_ID C00023101 ,
InChIKey HKXMBXXNJAICIG-UXQSFTDGNA-N
InChICode InChI=1S/C50H74O4/c1-37(2)31-34-45(50(13,14)53)47-46(54-47)43(8)30-20-29-41(6)26-18-24-39(4)22-16-15-21-38(3)23-17-25-40(5)27-19-28-42(7)32-33-44(49(11,12)52)35-36-48(9,10)51/h15-33,44-47,51-53H,34-36H2,1-14H3/b16-15+,23-17+,24-18+,27-19+,29-20+,33-32+,38-21+,39-22+,40-25+,41-26+,42-28+,43-30+/t44-,45+,46-,47-/m1/s1
SMILES C(=C\C(=C\C=C\C(=C\C=C\C=C(\C=C\C=C(/C=C/C=C(/[C@@H]1[C@@H]([C@@H](C(C)(O)C)CC=C(C)C)O1)\C)\C)/C)\C)\C)/C=C(/C=C/[C@@H](C(C)(O)C)CCC(C)(C)O)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
ArchaeaHalobacteriaceaeHaloferax volcanii Ref.
zoom in