input word = C00041552

Metabolite InformationStructural formula
Name Globostellatic acid G
Formula C31H46O6
Mw 514.3294392
CAS RN 877376-76-6
C_ID C00041552 ,
InChIKey SZHMATBACCQYNZ-AWJXJGAUNA-N
InChICode InChI=1S/C31H46O6/c1-19(12-13-25(37-8)28(3,4)36)10-9-11-20(2)26-21(32)18-23-29(5)17-15-24(33)31(7,27(34)35)22(29)14-16-30(23,26)6/h9-13,22-25,33,36H,14-18H2,1-8H3,(H,34,35)/b11-9+,13-12+,19-10+,26-20+/t22-,23+,24-,25-,29+,30+,31-/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)OC)/C)/C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Rhabdastrella globostellata Ref.
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