input word = C00048846

Metabolite InformationStructural formula
Name Rotiorinol A
Formula C23H26O5
Mw 382.17802394
CAS RN 901309-41-9
C_ID C00048846 ,
InChIKey QXVIQXFZWZQGMX-ILVKHSHCNA-N
InChICode InChI=1S/C23H26O5/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/h7-13,21,25H,6H2,1-5H3/b8-7+,14-9+/t13-,21+,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@H](O)C2=CO1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiChaetomiaceaeChaetomium cupreum CC3003 Ref.
--Chactomium cupreum CC3003 Ref.
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