Vitas-M small molecule compound
(1S,2S,12bR,12cR)-2,3,3a,4,5,7,12b,12c-octahydro-1H-[1,3]dioxolo[4,5-j]pyrrolo[3,2,1-de]phenanthridine-1,2-diol
Catalog ID
STL443727
SMILES O[C@H]1CC2CCN3[C@H]2[C@H]([C@@H]1O)c1cc2OCOc2cc1C3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H19NO4 MW 289.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19NO4/c18-11-3-8-1-2-17-6-9-4-12-13(21-7-20-12)5-10(9)14(15(8)17)16(11)19/h4-5,8,11,14-16,18-19H,1-3,6-7H2/t8?,11-,14+,15+,16+/m0/s1InChIKey
VJILFEGOWCJNIK-QIINFIFLSA-NSynonyms
(1S2S12bR12cR)233a45712b12coctahydro1H(13)dioxolo(45j)pyrrolo(321de)phenanthridine12diol
(1S2S12bS)233a3a145712boctahydro1H(13)dioxolo(45j)pyrrolo(321de)phenanthridine12diol
C1CN2CC3=CC4=C(C=C3C5C2C1CC(C5O)O)OCO4
InChI=1SC16H19NO4c18113812176941213(2172012)510(9)14(15(8)17)16(11)19h4581114161819H1367H2t8?1114+15+16+m0s1
MFCD19442596
O(C@H)1CC2CCN3(C@H)2(C@H)((C@@H)1O)c1cc2OCOc2cc1C3
O(C@H)1CC2CCN3C2(C@@H)((C@@H)1O)c1cc2OCOc2cc1C3
ZINC000014887529
ZINC000014887535
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