input word = C00045714

Metabolite InformationStructural formula
Name Calyculaglycoside D
(-)-Calyculaglycoside D
Formula C28H46O7
Mw 494.32435382
CAS RN 386211-74-1
C_ID C00045714 ,
InChIKey CJUXBFMESPSGKO-IZZDRSDZNA-N
InChICode InChI=1S/C28H46O7/c1-18-9-7-11-19(2)13-15-22(16-14-20(3)12-8-10-18)28(5,6)35-27-26(32)25(31)24(30)23(34-27)17-33-21(4)29/h9,12-13,22-27,30-32H,7-8,10-11,14-17H2,1-6H3/b18-9+,19-13+,20-12+/t22-,23-,24+,25+,26-,27+/m1/s1
SMILES CC(=O)OC[C@H]1O[C@@H](OC(C)(C)[C@@H]2C/C=C(C)CC/C=C(C)CC/C=C(C)CC2)[C@H](O)[C@@H](O)[C@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
--Eunicea sp. Ref.
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