input word = C00041065

Metabolite InformationStructural formula
Name Moldenin
(+)-Moldenin
Formula C40H64O4
Mw 608.48046053
CAS RN 221378-26-3
C_ID C00041065 ,
InChIKey XQDCOJOGYBLPKT-FFTXTANRNA-N
InChICode InChI=1S/C40H64O4/c1-26(11-15-30-28(3)13-17-32-37(5,6)34(41)19-22-39(30,32)9)21-24-44-36(43)25-27(2)12-16-31-29(4)14-18-33-38(7,8)35(42)20-23-40(31,33)10/h26-27,30-33H,3-4,11-25H2,1-2,5-10H3/t26-,27-,30-,31-,32-,33-,39-,40-/m0/s1
SMILES C(C[C@@H](CCOC(=O)C[C@H](CC[C@H]1C(=C)CC[C@@H]2[C@]1(CCC(=O)C2(C)C)C)C)C)[C@@H]1[C@]2([C@@H](CCC1=C)C(C(=O)CC2)(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Moldenhavera nutans Ref.
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OrganismMoldenhavera nutans
ReferenceDavid,Phytochem.,50,(1999),443