input word = C00043630

Metabolite InformationStructural formula
Name Kansuinin H
(+)-Kansuinin H
Formula C37H46O16
Mw 746.27858542
CAS RN 770715-06-5
C_ID C00043630 ,
InChIKey JUCOOGZXMGBGJB-TVLXFDHANA-N
InChICode InChI=1S/C37H46O16/c1-17-27(47-19(3)38)25-30(49-21(5)40)35(10,45)16-36(25,52-23(7)42)37(46)18(2)26(43)31(53-37)34(8,9)32(50-22(6)41)29(28(17)48-20(4)39)51-33(44)24-14-12-11-13-15-24/h11-15,18,25,27-32,45-46H,1,16H2,2-10H3/t18-,25+,27+,28+,29-,30-,31-,32-,35-,36-,37-/m1/s1
SMILES O1[C@]2([C@@]3([C@@H]([C@H](C(=C)[C@@H]([C@H]([C@H](C([C@H]1C(=O)[C@H]2C)(C)C)OC(=O)C)OC(=O)c1ccccc1)OC(=O)C)OC(=O)C)[C@H]([C@](C3)(C)O)OC(=O)C)OC(=O)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeEuphorbia kansui Ref.
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