input word = C00043782

Metabolite InformationStructural formula
Name Norcaesalpinin MC
(+)-Norcaesalpinin MC
Formula C25H32O9
Mw 476.20463262
CAS RN 817168-22-2
C_ID C00043782 ,
InChIKey CVNRGMCZFLKLMH-RRWDNRPRNA-N
InChICode InChI=1S/C25H32O9/c1-12(26)32-18-7-9-23(4,5)25(30)22(34-14(3)28)21(33-13(2)27)19-16(24(18,25)6)11-17-15(20(19)29)8-10-31-17/h8,10,16,18-19,21-22,30H,7,9,11H2,1-6H3/t16-,18-,19+,21+,22-,24-,25+/m0/s1
SMILES [C@H]1([C@]2([C@](C(CC1)(C)C)([C@H]([C@@H]([C@@H]1[C@@H]2Cc2c(C1=O)cco2)OC(=O)C)OC(=O)C)O)C)OC(=O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeCaesalpinia crista Ref.
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