input word = C00046484

Metabolite InformationStructural formula
Name Ulmicin A
(-)-Ulmicin A
Formula C38H56O6
Mw 608.40768952
CAS RN 336621-22-8
C_ID C00046484 ,
InChIKey SFWXTEAVJISKCL-PBVAVEHVNA-N
InChICode InChI=1S/C38H56O6/c1-21(2)23-12-15-35(5)20-30(41)38(8)24(31(23)35)19-27(44-33(42)22-10-11-25(39)26(18-22)43-9)32-36(6)16-14-29(40)34(3,4)28(36)13-17-37(32,38)7/h10-11,18,23-24,27-32,39-41H,1,12-17,19-20H2,2-9H3/t23-,24+,27+,28-,29-,30+,31-,32+,35+,36-,37+,38-/m0/s1
SMILES C=C(C)[C@@H]1CC[C@]2(C)C[C@@H](O)[C@]3(C)[C@H](C[C@@H](OC(=O)c4ccc(O)c(OC)c4)[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]12
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeUlmaceaeUlmus davidiana var.japonica Ref.
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