input word = C00030156

Metabolite InformationStructural formula
Name Dryopteric acid A
(+)-4-epi-Dryopteric B
Formula C30H48O3
Mw 456.3603454
CAS RN 1041795-45-2
C_ID C00030156 ,
InChIKey FACSHOVTXPPTBM-JCXKJXDRNA-N
InChICode InChI=1S/C30H48O3/c1-18(2)20-10-13-26(3)21(20)11-14-29(6)23(26)8-9-24-27(4)16-19(31)17-28(5,25(32)33)22(27)12-15-30(24,29)7/h19-24,31H,1,8-17H2,2-7H3,(H,32,33)/t19-,20+,21-,22+,23+,24+,26-,27-,28-,29+,30+/m0/s1
SMILES [C@@]12([C@@H](CC[C@@]3([C@@H]1CC[C@H]1[C@]3(CC[C@@H]3[C@@]1(C[C@@H](C[C@]3(C)C(=O)O)O)C)C)C)[C@H](CC2)C(=C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDryopteridaceaeDryopteris crassirhizoma Ref.
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