input word = C00015363

Metabolite InformationStructural formula
Name Sanglifehrin C
Formula C61H93N5O13
Mw 1103.67698809
CAS RN 187148-15-8
C_ID C00015363 ,
InChIKey GYXRDKLWEUPOMU-GNZVTIHANA-N
InChICode InChI=1S/C61H93N5O13/c1-12-43-31-38(6)61(64-55(43)71)41(9)53(70)40(8)51(78-61)34-49(69)36(4)21-15-13-16-22-37(5)50-27-18-14-17-26-48(68)39(7)54-45(28-29-60(10,76-11)79-54)56(72)63-52(35(2)3)57(73)62-47(33-42-23-19-24-44(67)32-42)58(74)66-30-20-25-46(65-66)59(75)77-50/h13-14,16-19,22-24,26,32,35-36,38-41,43,45-54,65,67-70H,12,15,20-21,25,27-31,33-34H2,1-11H3,(H,62,73)(H,63,72)(H,64,71)/b16-13+,18-14+,26-17+,37-22+/t36-,38-,39+,40-,41-,43-,45+,46-,47-,48-,49-,50-,51-,52-,53-,54+,60-,61+/m0/s1
SMILES C1(=O)[C@H](C[C@@H]([C@]2(N1)[C@H]([C@H]([C@H]([C@@H](O2)C[C@H](O)[C@H](CC/C=C/C=C(/[C@@H]1C/C=C/C=C/[C@@H]([C@H]([C@@H]2[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N3N[C@H](C(=O)O1)CCC3)Cc1cccc(c1)O)C(C)C)CC[C@@](O2)(C)OC)C)O)\C)C)C)O)C)C)CC
Start Substs in Alk. Biosynthesis (Prediction) L-Pro
Organism
Kingdom Family Species Reference
BacteriaStreptomycetaceaeStreptomyces sp. A92-308110 Ref.
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