input word = C00041554

Metabolite InformationStructural formula
Name Globostellatic acid I
Formula C32H48O6
Mw 528.34508926
CAS RN 877376-78-8
C_ID C00041554 ,
InChIKey KVCMGGNWBHHERQ-PPUARJAONA-N
InChICode InChI=1S/C32H48O6/c1-9-38-26(29(4,5)37)14-13-20(2)11-10-12-21(3)27-22(33)19-24-30(6)18-16-25(34)32(8,28(35)36)23(30)15-17-31(24,27)7/h10-14,23-26,34,37H,9,15-19H2,1-8H3,(H,35,36)/b12-10+,14-13+,20-11+,27-21+/t23-,24+,25-,26+,30+,31+,32-/m1/s1
SMILES C1[C@]2([C@H]([C@]([C@@H](C1)O)(C(=O)O)C)CC[C@]1([C@H]2CC(=O)/C/1=C(/C=C/C=C(/C=C/[C@@H](C(C)(C)O)OCC)\C)\C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Rhabdastrella globostellata Ref.
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