input word = C00011318

Metabolite InformationStructural formula
Name Chaetoglobosin K
Formula C34H40N2O5
Mw 556.2937224
CAS RN 72509-61-6
C_ID C00011318 ,
InChIKey RSYKJHLWNMXRKZ-BNYJJVOENA-N
InChICode InChI=1S/C34H40N2O5/c1-6-23-28-29(20(4)22-17-35-25-13-8-7-11-21(22)25)36-32(40)34(28)24(31-33(23,5)41-31)12-9-10-18(2)16-19(3)30(39)26(37)14-15-27(34)38/h7-9,11-18,20,23-24,28-31,35,39H,6,10H2,1-5H3,(H,36,40)/b12-9+,15-14+,19-16+/t18-,20+,23-,24-,28-,29-,30+,31-,33+,34+/m0/s1
SMILES c1c2c(ccc1)c(c[nH]2)[C@H]([C@@H]1NC(=O)[C@]23C(=O)/C=C/C(=O)[C@@H](/C(=C/[C@H](C/C=C/[C@H]3[C@H]3[C@@]([C@H]([C@@H]12)CC)(O3)C)C)/C)O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Trp
Organism
Kingdom Family Species Reference
FungiBotryosphaeriaceaeDiplodia macrospora Ref.
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