YOHIMBINIC ACID MONOHYDRATE

CAS No.
522-87-2 ;207801-27-2
CCD No.
CCD00081461
Formula
C20 H24 N2 O3 . H2 O
MolWeight
358.435

Basic Information

Product Name: YOHIMBINIC ACID MONOHYDRATE
CAS: 522-87-2 ;207801-27-2
English Synonyms: YOHIMBINIC ACID MONOHYDRATE ; YOHIMBIC ACID MONOHYDRATE ; YOHIMBIC ACID HYDRATE
MDL Number.: MFCD00167087
H bond acceptor: 5
H bond donor: 3
Smile: c1ccc2c(c1)c3c([nH]2)[C@@H]4C[C@H]5[C@@H](CC[C@@H]([C@@H]5C(=O)O)O)CN4CC3.O
InChi: InChI=1S/C20H24N2O3.H2O/c23-17-6-5-11-10-22-8-7-13-12-3-1-2-4-15(12)21-19(13)16(22)9-14(11)18(17)20(24)25;/h1-4,11,14,16-18,21,23H,5-10H2,(H,24,25);1H2/t11-,14-,16-,17-,18+;/m0./s1
InChiKey: InChIKey=UXXCUDYYOMDFPX-GPRFVYSASA-N

Property

Melting Point: 267-268 DEG C (DEC)(LIT)
Comments: OPTICAL ACTIVITY: [ALPHA]25/D +142.0 DEG, C = 1 IN PYRIDINE
RIDADR: UN 1544 6.1/PG 3
UNSPSC: 12352100
WGK: 3

Safety information

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