input word = C00049287

Metabolite InformationStructural formula
Name Remangilone A
(+)-Remangilone A
Formula C28H38O4
Mw 438.2770097
CAS RN 223473-85-6
C_ID C00049287 ,
InChIKey YOZREUUANSRXNA-WYHKTQJWNA-N
InChICode InChI=1S/C28H38O4/c1-15-18-10-12-27(5)21(26(18,4)14-20(29)22(15)30)8-7-19-17-13-25(2,3)11-9-16(17)23(31)24(32)28(19,27)6/h7,14,16-17,21,24,29,32H,8-13H2,1-6H3/t16-,17+,21+,24-,26+,27+,28?/m0/s1
SMILES C1[C@@H]2[C@H](CCC1(C)C)C(=O)[C@@H]([C@@]1(C2=CC[C@H]2[C@]1(CCC1=C(C(=O)C(=C[C@@]21C)O)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePhysenaceaePhysena madagascariensis Ref.
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OrganismPhysena madagascariensis
ReferenceDeng,J.Nat.Prod.,62,(1999),471