input word = C00026801

Metabolite InformationStructural formula
Name Kapakahine G
Formula C55H66N10O10S
Mw 1058.46840913
CAS RN 530097-83-7
C_ID C00026801 ,
InChIKey YZVHZBGZAVQQDY-UHFFFAOYNA-N
InChICode InChI=1S/C55H66N10O10S/c1-30(2)44-53(74)62-24-13-21-42(62)48(69)60-45(31(3)66)49(70)58-38-28-55(35-17-9-11-19-40(35)64-52(73)43(65(51(38)72)54(55)64)26-32-14-6-5-7-15-32)63-29-33(34-16-8-10-18-39(34)63)27-36(56)46(67)57-37(22-25-76(4)75)50(71)61-23-12-20-41(61)47(68)59-44/h5-11,14-19,29-31,36-38,41-45,54,66H,12-13,20-28,56H2,1-4H3,(H,57,67)(H,58,70)(H,59,68)(H,60,69)/t31-,36-,37-,38+,41+,42-,43-,44+,45+,54+,55-,76+/m1/s1
SMILES CC(C)C1NC(=O)C2CCCN2C(=O)C(CCS(C)=O)NC(=O)C(N)Cc2cn(c3ccccc23)C23CC(NC(=O)C(C(C)O)NC(=O)C4CCCN4C1=O)C(=O)N1C(Cc4ccccc4)C(=O)N(c4ccccc42)C13
Start Substs in Alk. Biosynthesis (Prediction) L-Trp L-Pro Anthranilate
Organism
Kingdom Family Species Reference
--Cribrochalina olemda Ref.
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