Cas no 101222-61-1 (Yohimban-16-methanol,16,17-didehydro-, (20a)-(?脿)- (9CI))
101222-61-1 structure
Product Name:Yohimban-16-methanol,16,17-didehydro-, (20a)-(?脿)- (9CI)
CAS No:101222-61-1
MF:C20H24N2O
MW:308.417365074158
CID:167615
Update Time:2024-03-01
Yohimban-16-methanol,16,17-didehydro-, (20a)-(?脿)- (9CI) Chemical and Physical Properties
Names and Identifiers
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- (?à)-16-(Hydroxymethylene)-3a,15a,20a-yohimb-16-ene
- Benz[g]indolo[2,3-a]quinolizine,yohimban-16-methanol deriv.
- Nitraraine
- Yohimban-16-methanol, 16,17-didehydro-, (20α)-(±)-
- Yohimban-16-methanol,16,17-didehydro-, (20a)-(?脿)- (9CI)
-
- Inchi： 1S/C20H24N2O/c23-12-14-5-3-4-13-11-22-9-8-16-15-6-1-2-7-18(15)21-20(16)19(22)10-17(13)14/h1-2,5-7,13,17,19,21,23H,3-4,8-12H2/t13-,17+,19+/m1/s1
- InChI Key： ZRYNKHIKQVFQAE-FMEYXAORSA-N
- SMILES： C1=C(CO)[C@]2(C[C@@]3(N(C[C@]2(CC1)[H])CCC1C2=C(NC3=1)C=CC=C2)[H])[H]
Computed Properties
- Exact Mass: 272.08309
Experimental Properties
- Density: 1.27±0.1 g/cm3(Predicted)
- Boiling Point: 520.2±50.0 °C(Predicted)
- PSA: 52.54
- pka: 14.70±0.10(Predicted)
Yohimban-16-methanol,16,17-didehydro-, (20a)-(?脿)- (9CI) Related Literature
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Jing Yu,Yu-Qi Lyu,Jiapeng Liu,Mohammed B. Effat,Junxiong Wu J. Mater. Chem. A, 2019,7, 17995-18002
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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