input word = C00041934

Metabolite InformationStructural formula
Name Topsentisterol D1
(-)-Topsentisterol D1
Formula C29H44O2
Mw 424.33413065
CAS RN 918120-00-0
C_ID C00041934 ,
InChIKey RCOXCIVIRGPLSA-LRHVQXRWNA-N
InChICode InChI=1S/C29H44O2/c1-17(22-14-19(22)3)6-7-18(2)23-8-9-24-27-25(11-13-29(23,24)5)28(4)12-10-21(30)15-20(28)16-26(27)31/h16-19,21-24,30H,6-15H2,1-5H3/t17-,18-,19-,21+,22+,23-,24+,28+,29-/m1/s1
SMILES C1C2=C([C@H]3[C@](C1)([C@H](CC3)[C@H](C)CC[C@H]([C@@H]1C[C@H]1C)C)C)C(=O)C=C1[C@@]2(CC[C@@H](C1)O)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaHalichondriidaeTopsentia sp. Ref.
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