input word = C00057663

Metabolite InformationStructural formula
Name Sativalanosteronyl glucoside
Formula C36H56O7
Mw 600.40260414
CAS RN 934394-53-3
C_ID C00057663
InChIKey CMWNRBLXJWUZJM-DPWSZXNQSA-N
InChICode InChI=1S/C36H56O7/c1-20(2)25(38)11-9-21(3)22-13-17-36(8)24-10-12-27-33(4,5)28(15-16-34(27,6)23(24)14-18-35(22,36)7)43-32-31(41)30(40)29(39)26(19-37)42-32/h10,12,14,20-22,26,28-32,37,39-41H,9,11,13,15-19H2,1-8H3/t21-,22-,26-,28+,29-,30+,31-,32+,34-,35-,36+/m1/s1
SMILES CC(C)C(=O)CC[C@@H](C)[C@H]1CC[C@@]2(C)C3=CC=C4C(C)(C)[C@@H](O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)C3=CC[C@]12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePoaceaeOryza sativa Ref.
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