input word = C00044651

Metabolite InformationStructural formula
Name Cordianol C
(+)-Cordianol C
Formula C31H52O6
Mw 520.37638939
CAS RN 263723-42-8
C_ID C00044651 ,
InChIKey ANFJBMXRWPPYJK-LFTQGEGONA-N
InChICode InChI=1S/C31H52O6/c1-18(15-22(33)25(34)27(4,5)36-8)19-9-11-28(6)20(19)16-21(32)24-29(28,7)12-10-23-26(2,3)31(35)14-13-30(23,24)17-37-31/h15,19-25,32-35H,9-14,16-17H2,1-8H3/b18-15+/t19-,20-,21-,22+,23+,24+,25+,28-,29-,30-,31+/m1/s1
SMILES COC(C)(C)C(O)[C@@H](O)/C=C(C)[C@H]1CC[C@]2(C)[C@@H]1C[C@@H](O)[C@@H]1[C@]34CC[C@](O)(OC3)C(C)(C)[C@@H]4CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeBoraginaceaeCordia multispicata Ref.
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