Vitas-M small molecule compound
1-[(5xi)-abieta-8(14),9(11),12-trien-18-yl]-3-phenylurea
Catalog ID
STL528238
SMILES O=C(Nc1ccccc1)NC[C@]1(C)CCC[C@]2(C1CCc1c2ccc(c1)C(C)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 C27H36N2O MW 404.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H36N2O/c1-19(2)20-11-13-23-21(17-20)12-14-24-26(3,15-8-16-27(23,24)4)18-28-25(30)29-22-9-6-5-7-10-22/h5-7,9-11,13,17,19,24H,8,12,14-16,18H2,1-4H3,(H2,28,29,30)/t24?,26-,27+/m0/s1InChIKey
YZEYNPFQLPXVOR-CUBVPSHMSA-NSynonyms
1214623-11-61(((1~(R)4~(a)~(S))14~(a)dimethyl7propan2yl23491010~(a)hexahydrophenanthren1yl)methyl)3phenylurea
1(((1R4aS)7isopropyl14adimethyl12344a91010aoctahydrophenanthren1yl)methyl)3phenylurea
1((5xi)abieta8(14)9(11)12trien18yl)3phenylurea
1214623116
16398459
InChI=1SC27H36N2Oc119(2)2011132321(1720)12142426(31581627(2324)4)182825(30)292296571022h5791113171924H812141618H214H3(H2282930)t24?2627+m0s1
MFCD03849857
O=C(Nc1ccccc1)NC(C@)1(C)CCC(C@)2(C1CCc1c2ccc(c1)C(C)C)C
ZINC000004044334
ZINC000004044336
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