input word = C00057448

Metabolite InformationStructural formula
Name Phytoprostane D1-I
Formula C18H30O5
Mw 326.20932407
CAS RN 570368-01-3
C_ID C00057448
InChIKey MUKVIZSNYWHGCM-ZHACJKMWSA-N
InChICode InChI=1S/C18H30O5/c1-2-13(19)10-11-15-14(16(20)12-17(15)21)8-6-4-3-5-7-9-18(22)23/h10-11,13-16,19-20H,2-9,12H2,1H3,(H,22,23)/b11-10+
SMILES CCC(O)/C=C/C1C(=O)CC(O)C1CCCCCCCC(=O)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeSolanaceaeLycopersicon esculentum Ref.
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