input word = C00029657

Metabolite InformationStructural formula
Name Agosterol G
11-O-Acetylagosterol F
Formula C33H52O8
Mw 576.36621864
CAS RN 603113-63-9
C_ID C00029657 ,
InChIKey CPBGNMKWCQJLLJ-PDCQBOASNA-N
InChICode InChI=1S/C33H52O8/c1-17(2)9-12-25(37)18(3)23-10-11-24-22-15-27(39-19(4)34)30-31(41-21(6)36)26(38)13-14-32(30,7)29(22)28(40-20(5)35)16-33(23,24)8/h15,17-18,23-31,37-38H,9-14,16H2,1-8H3/t18-,23+,24-,25+,26-,27+,28+,29+,30-,31-,32+,33+/m0/s1
SMILES CC(=O)O[C@@H]1[C@@H]2[C@@H](OC(C)=O)C=C3[C@H]([C@H](OC(C)=O)C[C@]4(C)[C@@H]([C@H](C)[C@H](O)CCC(C)C)CC[C@@H]34)[C@@]2(C)CC[C@@H]1O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
AnimaliaDictyodendrillidaeAcanthodendrilla sp. Ref.
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