input word = C00029466

Metabolite InformationStructural formula
Name 2-O-trans-p-coumaroyl maslinic acid
Formula C39H54O6
Mw 618.39203946
CAS RN 929694-38-2
C_ID C00029466 ,
InChIKey SCUAVOSMBKGQAQ-LEDGBPDVNA-N
InChICode InChI=1S/C39H54O6/c1-34(2)18-20-39(33(43)44)21-19-37(6)26(27(39)22-34)13-14-30-36(5)23-28(32(42)35(3,4)29(36)16-17-38(30,37)7)45-31(41)15-10-24-8-11-25(40)12-9-24/h8-13,15,27-30,32,40,42H,14,16-23H2,1-7H3,(H,43,44)/b15-10+/t27-,28+,29-,30+,32-,36-,37+,38+,39-/m0/s1
SMILES CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@@H](OC(=O)/C=C/c6ccc(O)cc6)[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeElaeagnaceaeHippophae rhamnoides L. Ref.
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OrganismHippophae rhamnoides L.
ReferenceYang,Chem.Pharm.Bull.,55,(2007),15