input word = C00016350

Metabolite InformationStructural formula
Name Stachybotrin C
Formula C31H39NO5
Mw 505.28282336
CAS RN 150351-23-8
C_ID C00016350 ,
InChIKey VXPNPWUFHMIFJE-ONEAXESVNA-N
InChICode InChI=1S/C31H39NO5/c1-20(2)7-5-8-21(3)9-6-15-31(4)28(35)18-25-27(34)17-24-26(29(25)37-31)19-32(30(24)36)16-14-22-10-12-23(33)13-11-22/h7,9-13,17,28,33-35H,5-6,8,14-16,18-19H2,1-4H3/b21-9+/t28-,31-/m1/s1
SMILES c12c(cc(c3c1O[C@@]([C@@H](C3)O)(CC/C=C(/CCC=C(C)C)\C)C)O)C(=O)N(C2)CCc1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
--Stachybotrys parvispora F4708 Ref.
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