74872-89-2
9,15-DIOXO-PROSTA-5Z,10-DIEN-1-OIC ACID
Name
9,15-DIOXO-PROSTA-5Z,10-DIEN-1-OIC ACID
Formula
C20 H30 O4
MolWeight
334.453
1Identification
【Name】
9,15-DIOXO-PROSTA-5Z,10-DIEN-1-OIC ACID
【CAS】
【MDL】
MFCD00135204
【English Synonyms】
【Formula】
C20 H30 O4
【MolWeight】
334.453
【Inchi】
InChI=1S/C20H30O4/c1-2-3-6-9-17(21)14-12-16-13-15-19(22)18(16)10-7-4-5-8-11-20(23)24/h4,7,13,15-16,18H,2-3,5-6,8-12,14H2,1H3,(H,23,24)/b7-4-/t16-,18+/m0/s1
【InChIKey】
InChIKey=FMKLAIBZMCURLI-BFVRRIQPSA-N
【SMILES】
CCCCCC(=O)CC[C@H]1C=CC(=O)[C@@H]1C/C=C\CCCC(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
9,15-DIOXO-PROSTA-5Z,10-DIEN-1-OIC ACID.cml
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