input word = C00028879

Metabolite InformationStructural formula
Name Pseudostellarin F
Formula C38H56N8O10
Mw 784.41194007
CAS RN 158335-67-2
C_ID C00028879 ,
InChIKey QQQGBGKQDJAEAC-MRPMFSKTNA-N
InChICode InChI=1S/C38H56N8O10/c1-5-21(3)31-36(54)42-26(20-47)33(51)40-18-29(49)39-19-30(50)41-25(17-23-11-13-24(48)14-12-23)34(52)44-32(22(4)6-2)38(56)46-16-8-10-28(46)37(55)45-15-7-9-27(45)35(53)43-31/h11-14,21-22,25-28,31-32,47-48H,5-10,15-20H2,1-4H3,(H,39,49)(H,40,51)(H,41,50)(H,42,54)(H,43,53)(H,44,52)/t21-,22-,25-,26-,27-,28-,31-,32-/m0/s1
SMILES C1(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]2N(C(=O)[C@H]3N(C(=O)[C@@H](N1)[C@@H](C)CC)CCC3)CCC2)[C@@H](C)CC)CO)Cc1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction) L-Pro L-Lys
Organism
Kingdom Family Species Reference
PlantaeCaryophyllaceaePseudostellaria heterophylla Ref.
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OrganismPseudostellaria heterophylla
ReferenceMorita,J.Nat.Prod.,58,(1995),943