input word = C00052487

Metabolite InformationStructural formula
Name Rotiorin
(+)-Rotiorin
Formula C23H24O5
Mw 380.16237388
CAS RN 27781-60-8
C_ID C00052487
InChIKey CJMOMVNHRUTOJX-WCUWGRSFSA-N
InChICode InChI=1S/C23H24O5/c1-6-13(2)9-14(3)7-8-17-10-16-11-19-20(15(4)24)22(26)28-23(19,5)21(25)18(16)12-27-17/h7-13H,6H2,1-5H3/b8-7+,14-9+/t13-,23-/m0/s1
SMILES CC[C@H](C)/C=C(C)/C=C/C1=CC2=CC3=C(C(C)=O)C(=O)O[C@]3(C)C(=O)C2=CO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiChaetomiaceaeChaetomium cupreum CC3003 Ref.
FungiTrichocomaceaePenicillium multicolor NRRL 2060 Ref.
FungiTrichocomaceaePenicillium sclerotiorum Van Beyma Ref.
zoom in



OrganismPenicillium sclerotiorum Van Beyma
ReferenceGao, J-M. et al., Chem. Rev., 113, (2013), 4755-4811.