BETA-CORTOLONE ,667-66-3 _Chemical Cloud Database

BETA-CORTOLONE

Basic Information
Product Name：	BETA-CORTOLONE
CAS：	667-66-3
English Synonyms：	5BETA-PREGNAN-3ALPHA,17ALPHA,20BETA,21-TETROL-11-ONE ; 3ALPHA,17ALPHA,20BETA,21-TETRAHYDROXY-5BETA-PREGNAN-11-ONE ; 5BETA-PREGNAN-3ALPHA,17,20BETA,21-TETROL-11-ONE ; BETA-CORTOLONE
MDL Number.：	MFCD00070031
H bond acceptor：	5
H bond donor：	4
Smile：	C[C@]12CC[C@H](C[C@H]1CC[C@@H]3[C@@H]2C(=O)C[C@]4([C@H]3CC[C@@]4([C@@H](CO)O)O)C)O
InChi：	InChI=1S/C21H34O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h12-15,17-18,22-23,25-26H,3-11H2,1-2H3/t12-,13-,14+,15+,17-,18-,19+,20+,21+/m1/s1
InChiKey：	InChIKey=JXCOSKURGJMQSG-AIEJOZITSA-N

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