Vitas-M small molecule compound
(1S)-6'-butyl-3,10'-dimethyl-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromene]-4',8'(3'H)-dione
Catalog ID
STK618828
SMILES CCCCc1cc(=O)oc2c1cc1C(=O)C[C@]3(Oc1c2C)CCCC(C3)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 C23H28O4 MW 368.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28O4/c1-4-5-8-16-10-20(25)26-21-15(3)22-18(11-17(16)21)19(24)13-23(27-22)9-6-7-14(2)12-23/h10-11,14H,4-9,12-13H2,1-3H3/t14?,23-/m0/s1InChIKey
JXNJBNZHPPYGOK-AQJFCTLQSA-NSynonyms
1212473-54-5(1S)6butyl310dimethyl3Hspiro(cyclohexane12pyrano(32g)chromene)48dione
(1S)6butyl310dimethyl8Hspiro(cyclohexane12pyrano(32g)chromene)48(3H)dione
(2S)6butyl310dimethylspiro(3Hpyrano(32g)chromene21cyclohexane)48dione
1212473545
CCCCC1=CC(=O)OC2=C(C3=C(C=C12)C(=O)CC4(O3)CCCC(C4)C)C
CCCCc1cc(=O)oc2c1cc1C(=O)C(C@)3(Oc1c2C)CCCC(C3)C
InChI=1SC23H28O4c1458161020(25)262115(3)2218(1117(16)21)19(24)1323(2722)96714(2)1223h101114H491213H213H3t14?23m0s1
MFCD18158776
ZINC000013655091
ZINC000013655093
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