6615-00-5
11A-HYDROXY-ESTR-4-ENE-3,17-DIONE
Name
11A-HYDROXY-ESTR-4-ENE-3,17-DIONE
Formula
C18 H24 O3
MolWeight
288.385
1Identification
【Name】
11A-HYDROXY-ESTR-4-ENE-3,17-DIONE
【CAS】
【MDL】
MFCD09839035
【English Synonyms】
【Formula】
C18 H24 O3
【MolWeight】
288.385
【Inchi】
InChI=1S/C18H24O3/c1-18-9-15(20)17-12-5-3-11(19)8-10(12)2-4-13(17)14(18)6-7-16(18)21/h8,12-15,17,20H,2-7,9H2,1H3/t12-,13-,14-,15+,17+,18-/m0/s1
【InChIKey】
InChIKey=VDCOSJPGDDQNJH-JVSYPLCOSA-N
【SMILES】
C[C@]12C[C@H]([C@H]3[C@H]([C@@H]1CCC2=O)CCC4=CC(=O)CC[C@H]34)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
11A-HYDROXY-ESTR-4-ENE-3,17-DIONE.cml
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Boc Sciences
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