input word = C00041601

Metabolite InformationStructural formula
Name Integerrimide B
(-)-Integerrimide B
Formula C39H58N8O8
Mw 766.43776089
CAS RN 914294-43-2
C_ID C00041601 ,
InChIKey CPSZQDSIZKCEOY-COGLPXDCNA-N
InChICode InChI=1S/C39H58N8O8/c1-21(2)14-27-35(51)43-28(15-22(3)4)36(52)44-29(16-23(5)6)37(53)46-31(20-48)39(55)47-13-9-12-32(47)38(54)45-30(34(50)41-19-33(49)42-27)17-24-18-40-26-11-8-7-10-25(24)26/h7-8,10-11,18,21-23,27-32,40,48H,9,12-17,19-20H2,1-6H3,(H,41,50)(H,42,49)(H,43,51)(H,44,52)(H,45,54)(H,46,53)/t27-,28-,29-,30-,31-,32-/m0/s1
SMILES N1C(=O)[C@H]2N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1Cc1c[nH]c3c1cccc3)CC(C)C)CC(C)C)CC(C)C)CO)CCC2
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeJatropha integerrima Ref.
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