input word = C00045732

Metabolite InformationStructural formula
Name Casearvestrin C
(-)-Casearvestrin C
Formula C30H44O8
Mw 532.30361838
CAS RN 402935-06-2
C_ID C00045732 ,
InChIKey OWZBTGIYKSYHIP-AJDDRIKINA-N
InChICode InChI=1S/C30H44O8/c1-8-10-11-12-26(34)37-22-16-23-27(35-20(5)31)38-28(36-21(6)32)30(23)24(17-22)29(7,14-13-18(3)9-2)19(4)15-25(30)33/h9,13,16,19,22,24-25,27-28,33H,2,8,10-12,14-15,17H2,1,3-7H3/b18-13+/t19-,22-,24+,25+,27+,28-,29-,30+/m1/s1
SMILES C1[C@H]([C@@]([C@H]2[C@]3([C@H]1O)C(=C[C@H](C2)OC(=O)CCCCC)[C@H](O[C@H]3OC(=O)C)OC(=O)C)(C)C/C=C(\C)/C=C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSamydaceaeCasearia sylvestris Ref.
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