input word = C00046189

Metabolite InformationStructural formula
Name Nanjiol C
(+)-Nanjiol C
Formula C29H46O4
Mw 458.33960996
CAS RN 473739-40-1
C_ID C00046189 ,
InChIKey WDDRMCUVHMBDRI-PFBWHWJZNA-N
InChICode InChI=1S/C29H46O4/c1-18(2)8-7-13-29(6,32)26-25(33-19(3)30)17-24-22-10-9-20-16-21(31)11-14-27(20,4)23(22)12-15-28(24,26)5/h16,18,22-26,32H,7-15,17H2,1-6H3/t22-,23+,24+,25+,26+,27+,28+,29+/m1/s1
SMILES C1C(=O)C=C2[C@](C1)([C@@H]1[C@@H](CC2)[C@H]2[C@](CC1)([C@H]([C@H](C2)OC(=O)C)[C@](C)(CCCC(C)C)O)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Nephthea bayeri Ref.
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OrganismNephthea bayeri
ReferenceShao,J.Nat.Prod.,65,(2002),1675