input word = C00015139

Metabolite InformationStructural formula
Name Roridin L
Formula C29H38O9
Mw 530.25158281
CAS RN 390410-20-5
C_ID C00015139 ,
InChIKey CXUYRNDRKDXIHC-QZVSGYHJNA-N
InChICode InChI=1S/C29H38O9/c1-17-9-11-28-15-35-23(32)14-18(2)10-12-34-20(19(3)30)7-5-6-8-22(31)38-25-24(33)26(37-21(28)13-17)29(16-36-29)27(25,28)4/h5-8,13-14,19-21,24-26,30,33H,9-12,15-16H2,1-4H3/b7-5+,8-6+,18-14+/t19-,20+,21-,24+,25-,26+,27+,28-,29-/m0/s1
SMILES C\1=C/[C@@H](OCC/C(=C/C(=O)OC[C@]23[C@]4([C@@H](OC(=O)/C=C1)[C@@H](O)[C@H]([C@]14CO1)O[C@H]2C=C(CC3)C)C)/C)[C@H](C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiIncertae sedisMyrothecium verrucaria Ref.
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OrganismMyrothecium verrucaria
ReferenceMurakami,J.Antibiotics 54,(2001),980