PROPICILLIN ,4780-24-9 _Chemical Cloud Database

PROPICILLIN

Basic Information
Product Name：	PROPICILLIN
CAS：	4780-24-9 ;551-27-9
English Synonyms：	PROPICILLIN ; ISOPROPICILLIN
MDL Number.：	MFCD00864993
H bond acceptor：	7
H bond donor：	2
Smile：	CCC(C(=O)N[C@H]1[C@@H]2N(C1=O)[C@H](C(S2)(C)C)C(=O)O)Oc3ccccc3
InChi：	InChI=1S/C18H22N2O5S/c1-4-11(25-10-8-6-5-7-9-10)14(21)19-12-15(22)20-13(17(23)24)18(2,3)26-16(12)20/h5-9,11-13,16H,4H2,1-3H3,(H,19,21)(H,23,24)/t11?,12-,13+,16-/m1/s1
InChiKey：	InChIKey=HOCWPKXKMNXINF-XQERAMJGSA-N

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