input word = C00048638

Metabolite InformationStructural formula
Name Briaexcavatin T
(-)-Briaexcavatin T
Formula C26H35ClO10
Mw 542.19187505
CAS RN 1124328-11-5
C_ID C00048638 ,
InChIKey NSSVWBLUKDYCEE-CGKFVLESNA-N
InChICode InChI=1S/C26H35ClO10/c1-7-8-15(30)35-21-17-20(36-17)24(5)14(29)10-9-11(2)16(27)19-26(33,12(3)23(31)37-19)22(34-13(4)28)18(24)25(21,6)32/h9-10,12,14,16-22,29,32-33H,2,7-8H2,1,3-6H3/b10-9+/t12-,14-,16-,17+,18+,19-,20-,21+,22-,24+,25-,26-/m0/s1
SMILES C=C1/C=C/[C@H](O)[C@@]2(C)[C@H]3O[C@H]3[C@@H](OC(=O)CCC)[C@@](C)(O)[C@@H]2[C@H](OC(C)=O)C2(O)[C@@H](C)C(=O)O[C@H]2[C@H]1Cl
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Briareum excavatum Ref.
zoom in