input word = C00017263

Metabolite InformationStructural formula
Name L 696475
Formula C30H39NO3
Mw 461.29299412
CAS RN 142494-54-0
C_ID C00017263 ,
InChIKey YXPQASAXLVDDEP-BBXOWAOSNA-N
InChICode InChI=1S/C30H39NO3/c1-19-10-9-13-25-17-21(3)22(4)28-26(18-24-11-7-6-8-12-24)31-29(33)30(25,28)27(34-23(5)32)15-14-20(2)16-19/h6-9,11-15,17,19-20,22,25-28H,10,16,18H2,1-5H3,(H,31,33)/b13-9+,15-14+/t19-,20+,22-,25-,26+,27+,28+,30-/m0/s1
SMILES [C@]123[C@@H](/C=C/[C@H](C[C@H](C/C=C/[C@H]1C=C([C@@H]([C@@H]2[C@H](NC3=O)Cc1ccccc1)C)C)C)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction) L-Asp L-Phe
Organism
Kingdom Family Species Reference
FungiXylariaceaeHypoxylon fragiforme (ATCC 20995 MF5511) Ref.
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