input word = C00046873

Metabolite InformationStructural formula
Name Quadrangularic acid L
(+)-Quadrangularic acid L
Formula C30H50O6
Mw 506.36073933
CAS RN 254757-96-5
C_ID C00046873 ,
InChIKey WWIHQMXKPHUIKR-SQRVUIDKNA-N
InChICode InChI=1S/C30H50O6/c1-17(7-10-21(31)25(2,3)36)18-11-12-27(5)19-8-9-20-28(6,24(34)35)22(32)15-23(33)30(20)16-29(19,30)14-13-26(18,27)4/h17-23,31-33,36H,7-16H2,1-6H3,(H,34,35)/t17-,18-,19+,20+,21-,22+,23+,26-,27+,28+,29+,30-/m1/s1
SMILES C1[C@@H]([C@]([C@H]2[C@]3([C@H]1O)[C@]1([C@@H](CC2)[C@]2([C@](CC1)([C@H](CC2)[C@@H](CC[C@H](C(O)(C)C)O)C)C)C)C3)(C(=O)O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCombretaceaeCombretum quadrangulare Ref.
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