input word = C00042515

Metabolite InformationStructural formula
Name Fomitopinic acid B
(+)-Fomitopinic acid B
Formula C32H52O6
Mw 532.37638939
CAS RN 847454-59-5
C_ID C00042515 ,
InChIKey ZYJIVIYINCIQAB-HBABLTJCNA-N
InChICode InChI=1S/C32H52O6/c1-19(33)38-26-15-16-30(6)22-14-18-31(7)21(20(27(35)36)9-12-25(34)29(4,5)37)13-17-32(31,8)23(22)10-11-24(30)28(26,2)3/h20-21,24-26,34,37H,9-18H2,1-8H3,(H,35,36)/t20-,21+,24-,25-,26+,30+,31+,32-/m0/s1
SMILES C1C2=C([C@]3([C@](C1)([C@H](CC3)[C@@H](C(=O)O)CC[C@@H](C(C)(C)O)O)C)C)CC[C@@H]1[C@@]2(CC[C@H](C1(C)C)OC(=O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiFomitopsidaceaeFomitopsis pinicola (Pers.) Pat. Ref.
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OrganismFomitopsis pinicola (Pers.) Pat.
ReferenceYoshikawa,J.Nat.Prod.,68,(2005),69