input word = C00034087

Metabolite InformationStructural formula
Name Odoralide
(+)-Odoralide
Formula C33H44O13
Mw 648.27819149
CAS RN 1037528-32-7
C_ID C00034087 ,
InChIKey RSIYXEAXVGYFPE-JJXVURRMNA-N
InChICode InChI=1S/C33H44O13/c1-16(34)42-20-14-30(6)26(19-10-11-41-15-19)45-28(38)27-33(30,46-27)32(8)23(44-18(3)36)12-21(29(4,5)39)31(7,25(20)32)22(43-17(2)35)13-24(37)40-9/h10-11,15,20-23,25-27,39H,12-14H2,1-9H3/t20-,21-,22-,23+,25+,26-,27+,30-,31+,32+,33+/m0/s1
SMILES C1[C@H]([C@@]([C@@H]2[C@@]([C@@H]1OC(=O)C)([C@]13[C@@](C[C@@H]2OC(=O)C)([C@@H](OC(=O)[C@H]1O3)c1ccoc1)C)C)([C@H](CC(=O)OC)OC(=O)C)C)C(C)(O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Cedrala odorata Ref.
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OrganismCedrala odorata
ReferenceKipassa,Phytochem.,69,(2008),1782