Vitas-M small molecule compound
8-hexyl-4-oxo-1,2,3,4-tetrahydrocyclopenta[c]chromen-7-yl N-[(benzyloxy)carbonyl]-beta-alaninate
Catalog ID
STL464514
SMILES CCCCCCc1cc2c(cc1OC(=O)CCNC(=O)OCc1ccccc1)oc(=O)c1c2CCC1
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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 C29H33NO6 MW 491.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33NO6/c1-2-3-4-8-12-21-17-24-22-13-9-14-23(22)28(32)36-26(24)18-25(21)35-27(31)15-16-30-29(33)34-19-20-10-6-5-7-11-20/h5-7,10-11,17-18H,2-4,8-9,12-16,19H2,1H3,(H,30,33)InChIKey
NQISNCPXCAZLNE-UHFFFAOYSA-NSynonyms
301196-63-4(8HEXYL4OXO23DIHYDRO1HCYCLOPENTA(C)CHROMEN7YL)3(PHENYLMETHOXYCARBONYLAMINO)PROPANOATE
301196634
8hexyl4oxo1234tetrahydrocyclopenta(c)chromen7yl3(((benzyloxy)carbonyl)amino)propanoate
8hexyl4oxo1234tetrahydrocyclopenta(c)chromen7ylN((benzyloxy)carbonyl)betaalaninate
CCCCCCC1=C(C=C2C(=C1)C3=C(CCC3)C(=O)O2)OC(=O)CCNC(=O)OCC4=CC=CC=C4
InChI=1SC29H33NO6c1234812211724221391423(22)28(32)3626(24)1825(21)3527(31)15163029(33)341920106571120h5710111718H2489121619H21H3(H3033)
MFCD01544146
ZINC000005225018
ZINC05225018
ZINC5225018
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