input word = C00038894

Metabolite InformationStructural formula
Name Cyclomontanin B
Formula C34H49N9O10
Mw 743.36023885
CAS RN 1041854-76-5
C_ID C00038894 ,
InChIKey XYTBGJYRMURKBQ-TWXCVIBFNA-N
InChICode InChI=1S/C34H49N9O10/c1-5-16(2)27-33(52)40-22(14-25(36)46)30(49)38-17(3)29(48)39-21(13-24(45)19-9-6-7-10-20(19)35)31(50)42-28(18(4)44)34(53)43-12-8-11-23(43)32(51)37-15-26(47)41-27/h6-7,9-10,16-18,21-23,27-28,44H,5,8,11-15,35H2,1-4H3,(H2,36,46)(H,37,51)(H,38,49)(H,39,48)(H,40,52)(H,41,47)(H,42,50)/t16-,17+,18-,21+,22+,23+,27?,28-/m1/s1
SMILES [C@H]1(C(=O)N2[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1)CC(=O)c1c(cccc1)N)C)CC(=O)N)[C@H](C)CC)CCC2)[C@@H](C)O
Start Substs in Alk. Biosynthesis (Prediction) L-Arg L-Asp
Organism
Kingdom Family Species Reference
PlantaeAnnonaceaeAnnona montana Ref.
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