input word = C00049289

Metabolite InformationStructural formula
Name Remangilone C
(+)-Remangilone C
Formula C28H40O4
Mw 440.29265977
CAS RN 223389-58-0
C_ID C00049289 ,
InChIKey QQWIUBKPPNCYMY-KNANZPNLNA-N
InChICode InChI=1S/C28H40O4/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/h7,16-18,21,24,30,32H,8-14H2,1-6H3/t16-,17+,18-,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(CC[C@@H]1[C@@]2(CC(=O)C(=C1C)O)C)C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePhysenaceaePhysena madagascariensis Ref.
zoom in



OrganismPhysena madagascariensis
ReferenceDeng,J.Nat.Prod.,62,(1999),471