input word = C00030592

Metabolite InformationStructural formula
Name Kansuiphorin A
(-)-Kansuiphorin A
Formula C54H90O9
Mw 882.65848447
CAS RN 135883-24-8
C_ID C00030592 ,
InChIKey ILEDHBXLZDJQHK-UHFFFAOYNA-N
InChICode InChI=1S/C54H90O9/c1-10-12-14-16-18-20-21-22-23-25-26-28-30-32-44(55)61-37-42-34-43-46-51(8,9)53(46,63-45(56)33-31-29-27-24-19-17-15-13-11-2)36-40(6)52(48(43)58)35-39(5)49(54(52,60)47(42)57)62-50(59)41(7)38(3)4/h34-35,38,40-41,43,46-47,49,57,60H,10-33,36-37H2,1-9H3/t40-,41-,43-,46-,47+,49-,52+,53+,54-/m1/s1
SMILES C1(=O)[C@@]23[C@@]([C@H](C(=C[C@@H]1[C@H]1[C@@](C[C@H]2C)(C1(C)C)OC(=O)CCCCCCCCCCC)COC(=O)CCCCCCCCCCCCCCC)O)([C@@H](C(=C3)C)OC(=O)[C@H](C)C(C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeEuphorbiaceaeEuphorbia kansui Ref.
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