input word = C00023079

Metabolite InformationStructural formula
Name 2-Isopentenyl-3,4-dehydrorhodopin
Formula C45H64O
Mw 620.49571666
CAS RN 24292-28-2
C_ID C00023079 ,
InChIKey KMABSCJZIWNFFA-GOLFZPHXNA-N
InChICode InChI=1S/C45H64O/c1-36(2)20-15-23-40(7)26-18-29-41(8)27-16-24-38(5)21-13-14-22-39(6)25-17-28-42(9)30-19-31-43(10)33-35-44(45(11,12)46)34-32-37(3)4/h13-14,16-22,24-33,35,44,46H,15,23,34H2,1-12H3/b14-13+,24-16+,25-17+,29-18+,30-19+,35-33+,38-21+,39-22+,40-26+,41-27+,42-28+,43-31+/t44-/m0/s1
SMILES C(=C\C(=C\C=C\C(=C\C=C\C=C(\C=C\C=C(\C=C\C=C(\CCC=C(C)C)/C)/C)/C)\C)\C)/C=C(/C=C/[C@@H](C(C)(O)C)CC=C(C)C)\C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaCorynebacteriaceaeCorynebacterium poinsettiae Ref.
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