input word = C00049288

Metabolite InformationStructural formula
Name Remangilone B
(+)-Remangilone B
Formula C28H38O3
Mw 422.28209508
CAS RN 223473-86-7
C_ID C00049288 ,
InChIKey RZJRSJIUNPKJLS-UFCGSMJSNA-N
InChICode InChI=1S/C28H38O3/c1-16-19-10-12-27(5)23(26(19,4)14-22(30)24(16)31)8-7-20-18-13-25(2,3)11-9-17(18)21(29)15-28(20,27)6/h7,14,17-18,23,30H,8-13,15H2,1-6H3/t17-,18?,23+,26?,27+,28+/m0/s1
SMILES C1[C@@H]2[C@H](CCC1(C)C)C(=O)C[C@@]1(C2=CC[C@H]2[C@]1(CCC1=C(C(=O)C(=C[C@@]21C)O)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePhysenaceaePhysena madagascariensis Ref.
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