input word = C00028424

Metabolite InformationStructural formula
Name Kapakahine B
(-)-Kapakahine B
Formula C49H52N8O6
Mw 848.40098145
CAS RN 165406-94-0
C_ID C00028424 ,
InChIKey LYSCUZOEWWYEAH-BHQNVIGSNA-N
InChICode InChI=1S/C49H52N8O6/c1-4-28(2)41-45(61)53-37-26-49(34-20-12-14-22-39(34)56-47(63)40(57(46(37)62)48(49)56)24-31-17-9-6-10-18-31)55-27-32(33-19-11-13-21-38(33)55)25-36(44(60)51-29(3)42(58)54-41)52-43(59)35(50)23-30-15-7-5-8-16-30/h5-22,27-29,35-37,40-41,48H,4,23-26,50H2,1-3H3,(H,51,60)(H,52,59)(H,53,61)(H,54,58)/t28-,29-,35-,36-,37-,40-,41-,48-,49-/m0/s1
SMILES C1(=O)N2[C@H]3[C@]4(C[C@@H]1NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1c5c(n4c1)cccc5)NC(=O)[C@H](Cc1ccccc1)N)C)[C@H](CC)C)c1c(N3C(=O)[C@@H]2Cc2ccccc2)cccc1
Start Substs in Alk. Biosynthesis (Prediction) L-Trp Anthranilate L-Phe
Organism
Kingdom Family Species Reference
--Cribrochalina olemda Ref.
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