input word = C00015095

Metabolite InformationStructural formula
Name GEX 1Q3
Formula C31H50O12
Mw 614.33022706
CAS RN 192320-36-8
C_ID C00015095 ,
InChIKey AYMYUCNZABRFKF-DQGIKPJINA-N
InChICode InChI=1S/C31H50O12/c1-15(14-31(6)28(43-31)18(4)26(39-7)19(5)32)9-8-10-16(2)25-17(3)11-12-20(40-25)13-21(33)41-30-24(36)22(34)23(35)27(42-30)29(37)38/h8-10,15,17-20,22-28,30,32,34-36H,11-14H2,1-7H3,(H,37,38)/b9-8+,16-10+/t15-,17+,18-,19-,20-,22-,23+,24+,25-,26-,27-,28-,30+,31-/m1/s1
SMILES CO[C@H]([C@@H](C)[C@H]1O[C@]1(C)C[C@H](C)/C=C/C=C(C)[C@H]1O[C@@H](CC(=O)OC2OC(C(=O)O)C(O)C(O)C2O)CC[C@@H]1C)[C@@H](C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. GEX1 (FERM BP-5347) Ref.
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