Vitas-M small molecule compound
(7S,10Z)-7-(acetylamino)-10-(butan-2-yliminio)-1,2,3-trimethoxy-5,6,7,10-tetrahydrobenzo[a]heptalen-9-olate
Catalog ID
STL528405
SMILES CCC(/[NH+]=c\1/ccc2c(cc1[O-])[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
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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 C25H32N2O5 MW 440.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H32N2O5/c1-7-14(2)26-20-11-9-17-18(13-21(20)29)19(27-15(3)28)10-8-16-12-22(30-4)24(31-5)25(32-6)23(16)17/h9,11-14,19H,7-8,10H2,1-6H3,(H,26,29)(H,27,28)/t14?,19-/m0/s1InChIKey
WJDNCFAZVPJJSR-PKDNWHCCSA-NSynonyms
1212467-82-7(7S10Z)7(acetylamino)10(butan2yliminio)123trimethoxy56710tetrahydrobenzo(a)heptalen9olate
~(N)((7~(S))10(butan2ylamino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1212467827
16397912
InChI=1SC25H32N2O5c1714(2)26201191718(1321(20)29)19(2715(3)28)108161222(304)24(315)25(326)23(16)17h9111419H7810H216H3(H2629)(H2728)t14?19m0s1
ZINC000002944427
ZINC000002944429
Check stock
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