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(16alpha,17alpha)-17-Hydroxyyohimban-16-Carboxylic Acid Hydrate (1:1)
[CAS# 207801-27-2]

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Identification
Name (16alpha,17alpha)-17-Hydroxyyohimban-16-Carboxylic Acid Hydrate (1:1)
Molecular Structure CAS#: 207801-27-2, (16alpha,17alpha)-17-Hydroxyyohimban-16-Carboxylic Acid Hydrate (1:1)
Molecular Formula C20H26N2O4
Molecular Weight 358.43
CAS Registry Number 207801-27-2
SMILES C1C[C@@H]([C@@H]([C@@H]2[C@@H]1CN3CCC4=C([C@@H]3C2)NC5=CC=CC=C45)C(=O)O)O.O
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 UXXCUDYYOMDFPX-GPRFVYSASA-N
Properties
Melting point 267-268°C (Expl.)
Refractive index (Cal.)
Market Analysis Reports
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