Vitas-M small molecule compound
(4aS)-12-oxo-N-phenyl-13-(prop-2-en-1-yl)-1,2,3,4,9,9a-hexahydro-4a,9-(epiminoethano)xanthene-11-carboxamide
Catalog ID
STL553098
SMILES C=CCN1C(=O)C(C(=O)Nc2ccccc2)C2C3[C@]1(CCCC3)Oc1c2cccc1
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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 C25H26N2O3 MW 402.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26N2O3/c1-2-16-27-24(29)22(23(28)26-17-10-4-3-5-11-17)21-18-12-6-7-14-20(18)30-25(27)15-9-8-13-19(21)25/h2-7,10-12,14,19,21-22H,1,8-9,13,15-16H2,(H,26,28)/t19?,21?,22?,25-/m0/s1InChIKey
HCKWLIFVKPDIEV-JNEKPGMPSA-NSynonyms
1212475-69-8(1~(S))16oxo~(N)phenyl15prop2enyl2oxa15azatetracyclo(7530^(110)0^(38))heptadeca357triene17carboxamide
(4aS)12oxoNphenyl13(prop2en1yl)123499ahexahydro4a9(epiminoethano)xanthene11carboxamide
(4aS)13allyl12oxoNphenyl123499ahexahydro4a9(epiminoethano)xanthene11carboxamide
1212475698
16398082
C=CCN1C(=O)C(C(=O)Nc2ccccc2)C2C3(C@)1(CCCC3)Oc1c2cccc1
InChI=1SC25H26N2O3c12162724(29)22(23(28)2617104351117)211812671420(18)3025(27)15981319(21)25h27101214192122H189131516H2(H2628)t19?21?22?25m0s1
ZINC000100749530
ZINC000229835167
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