Petuniolide A 12-ketone
Molecular Formula:
C29H40O7
InChI: InChI=1/C29H40O7/c1-14(19-13-26(5)25(3,4)35-28(7,33-19)36-26)17-8-9-18-22-16(12-20(30)27(17,18)6)15(2)29(24-23(22)32-24)11-10-21(31)34-29/h12,14-15,17-19,22-24H,8-11,13H2,1-7H3/t14-,15+,17u,18u,19-,22u,23?,24?,26+,27-,28+,29-/m1/s1
InChIKey: InChIKey=COCPASNZXWPLFW-VSEZAPGWBY
SMILES: CC1C2=CC(=O)C3(C(C2C4C(C15CCC(=O)O5)O4)CCC3C(C)C6CC7(C(OC(O6)(O7)C)(C)C)C)C
Names:
NSC633665
Petuniolide A 12-ketone
128255-52-7
Registries:
PubChem CID 6398602
PubChem ID 8142165
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