input word = C00003595

Metabolite InformationStructural formula
Name Tokoronin
Formula C32H52O9
Mw 580.36113326
CAS RN 27530-69-4
C_ID C00003595 ,
InChIKey GZMNAJUVLAIUAJ-PETRPBOGNA-N
InChICode InChI=1S/C32H52O9/c1-15-7-10-32(39-13-15)16(2)24-23(41-32)12-20-18-6-5-17-11-21(33)26(36)28(31(17,4)19(18)8-9-30(20,24)3)40-29-27(37)25(35)22(34)14-38-29/h15-29,33-37H,5-14H2,1-4H3/t15-,16+,17-,18-,19+,20+,21+,22+,23+,24+,25+,26-,27-,28-,29-,30+,31+,32-/m1/s1
SMILES [C@H]1([C@H](C[C@@H]2[C@]([C@@H]1O[C@@H]1[C@@H]([C@H]([C@H](CO1)O)O)O)([C@@H]1[C@@H](CC2)[C@H]2[C@](CC1)([C@@H]1[C@H](C2)O[C@]2([C@H]1C)OC[C@@H](CC2)C)C)C)O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeDioscoreaceaeDioscorea tokoro Ref.
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