Vitas-M small molecule compound
6,12-dioxo-4b,6,7,8a,9,10,10a,10b,11,12-decahydro-9,11-methano-13-oxa-5,8-dithia-7-azabenzo[4,5]cycloocta[1,2,3-cd]-s-indacene-14-carboxylic acid
Catalog ID
STL337064
SMILES OC(=O)C1C2C(=O)Oc3ccccc3C3C4C2CC1C4Sc1c3sc(=O)[nH]1
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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 C19H15NO5S2 MW 401.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15NO5S2/c21-17(22)12-8-5-7-11-10(15-16(26-14(8)11)20-19(24)27-15)6-3-1-2-4-9(6)25-18(23)13(7)12/h1-4,7-8,10-14H,5H2,(H,20,24)(H,21,22)InChIKey
NDQHCUSCDKVEEN-UHFFFAOYSA-NSynonyms
612dioxo4b678a91010a10b1112decahydro911methano13oxa58dithia7azabenzo(45)cycloocta(123cd)sindacene14carboxylicacid
612dioxo677a7a1899a111213bdecahydro5oxa1013dithia11aza79methanobenzo(45)cycloocta(123cd)sindacene14carboxylicacid
C1C2C3C4C1C(C2C(=O)OC5=CC=CC=C5C3C6=C(S4)NC(=O)S6)C(=O)O
InChI=1SC19H15NO5S2c2117(22)128571110(1516(2614(8)11)2019(24)2715)631249(6)2518(23)13(7)12h14781014H5H2(H2024)(H2122)
MFCD03670699
OC(=O)C1C2C(=O)Oc3ccccc3C3C4C2CC1C4Sc1c3sc(=O)(nH)1
ZINC000006062494
ZINC000239358368
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