input word = C00015998

Metabolite InformationStructural formula
Name GR 135402
Formula C34H48O9
Mw 600.32983313
CAS RN 204199-15-5
C_ID C00015998 ,
InChIKey YJGMLBISALRTRW-WMCWOTTFNA-N
InChICode InChI=1S/C34H48O9/c1-8-9-10-20(5)29(37)43-28-26(36)30(42-21(6)27(28)40-7)41-17-33-15-23-19(4)11-12-24(23)32(16-35)14-22(33)13-25(18(2)3)34(32,33)31(38)39/h8-10,13,16,18-19,21-24,26-28,30,36H,11-12,14-15,17H2,1-7H3,(H,38,39)/b9-8+,20-10-/t19-,21+,22+,23-,24-,26-,27-,28-,30-,32+,33+,34+/m1/s1
SMILES O(C(=O)/C(=C\C=C\C)/C)[C@H]1[C@@H]([C@@H](O[C@H]([C@@H]1O)OC[C@]12[C@@]3(C(=C[C@H]1C[C@@]3([C@H]1[C@H](C2)[C@@H](CC1)C)C=O)C(C)C)C(=O)O)C)OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
FungiMicroascaceaeGraphium putredinis F13302 Ref.
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