input word = C00030568

Metabolite InformationStructural formula
Name Junceol F
Formula C31H44O11
Mw 592.28836225
CAS RN 1092697-28-3
C_ID C00030568 ,
InChIKey QPXTUMRLHBAYSX-KFZAYYFNNA-N
InChICode InChI=1S/C31H44O11/c1-10-15(2)28(35)41-24-14-22(38-19(6)32)17(4)13-25-31(37,18(5)29(36)42-25)27(40-21(8)34)26-16(3)11-12-23(30(24,26)9)39-20(7)33/h13,15,18,22-27,37H,3,10-12,14H2,1-2,4-9H3/b17-13-/t15-,18+,22-,23+,24+,25+,26-,27+,30-,31-/m1/s1
SMILES C\1=C(\[C@@H](C[C@@H]([C@@]2([C@@H]([C@@H]([C@@]3([C@H]1OC(=O)[C@@H]3C)O)OC(=O)C)C(=C)CC[C@@H]2OC(=O)C)C)OC(=O)[C@@H](CC)C)OC(=O)C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Junceella juncea Ref.
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OrganismJunceella juncea
ReferenceSung,Chem.Pharm.Bull.,56,(2008),1276