input word = C00043137

Metabolite InformationStructural formula
Name (+)-Subersic acid
Formula C27H38O3
Mw 410.28209508
CAS RN 672922-56-4
C_ID C00043137 ,
InChIKey RIYHRKNIDKXDII-OEHQFCRUNA-N
InChICode InChI=1S/C27H38O3/c1-18(7-10-20-17-21(25(29)30)11-13-23(20)28)8-12-22-19(2)9-14-24-26(3,4)15-6-16-27(22,24)5/h7,11,13,17,24,28H,6,8-10,12,14-16H2,1-5H3,(H,29,30)/b18-7+/t24-,27+/m0/s1
SMILES [C@@]12([C@@H](CCC(=C1CC/C(=C/Cc1c(ccc(c1)C(=O)O)O)/C)C)C(CCC2)(C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaDictyodendrillidaeAcanthodendrilla sp. Ref.
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