MONOCROTALINE ,315-22-0 _Chemical Cloud Database

MONOCROTALINE

Basic Information
Product Name：	MONOCROTALINE
CAS：	315-22-0
English Synonyms：	(13ALPHA,14ALPHA)-14,19-DIHYDRO-12,13-DIHYDROXY-20-NORCROTOLANAN-11,15-DIONE ; MONOCROTALINE ; (4AR,7R,8R,9R,12BR)-8,9-DIHYDROXY-7,8,9-TRIMETHYL-2,3,4,4A,8,9,12,12B-OCTAHYDRO-7H-5,11-DIOXA-2A-AZA-CYCLOUNDECA[CD]PENTALENE-6,10-DIONE ; MONCROTALINE ; PYRROLIZIDINE ALKALOID ; CROTALIN ; MONOCROTALIN ; CROTALINE
MDL Number.：	MFCD00084656
H bond acceptor：	7
H bond donor：	2
Smile：	C[C@H]1C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@]([C@]1(C)O)(C)O
InChi：	InChI=1S/C16H23NO6/c1-9-13(18)23-11-5-7-17-6-4-10(12(11)17)8-22-14(19)16(3,21)15(9,2)20/h4,9,11-12,20-21H,5-8H2,1-3H3/t9-,11+,12+,15+,16-/m0/s1
InChiKey：	InChIKey=QVCMHGGNRFRMAD-XFGHUUIASA-N
Property
Melting Point：	204 DEG C (DEC)(LIT)/204 °C/204 °C
Comments：	RECONSTITUTION: DRIED DOWN, 100 MICROGRAM/ML AFTER RECONSTITUTION WITH 1 ML OF WATER RTECS: QB3140000 STORAGE TEMPERATURE: -20 DEG C WGK: 3
Specification：	ANALYTICAL STANDARD
Safety information
Symbol：	GHS06 GHS08
Signal word：	Danger
Hazard statements：	H301-H351
Precautionary statements：	P281-P301 + P310
hazard symbol：	T
Risk Code：	R:25-40
Safe Code：	S:36/37/39-45
UN Code：	1544
WGK Germany：	3

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