input word = C00049263

Metabolite InformationStructural formula
Name Phyllofolactone C
(+)-Phyllofolactone C
Formula C27H40O3
Mw 412.29774514
CAS RN 222960-89-6
C_ID C00049263 ,
InChIKey OTZAFYKTECUBAV-MJWNCQRPNA-N
InChICode InChI=1S/C27H40O3/c1-7-24(3)12-8-13-25(4)18(24)11-14-26(5)19-10-9-17-16(2)30-23(29)22(17)27(19,6)21(28)15-20(25)26/h16,18-20H,7-15H2,1-6H3/t16-,18-,19-,20+,24-,25-,26-,27+/m0/s1
SMILES CC[C@@]1(C)CCC[C@]2(C)[C@H]3CC(=O)[C@]4(C)C5=C(CC[C@H]4[C@]3(C)CC[C@@H]12)[C@H](C)OC5=O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Phyllospongia foliascens Ref.
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