Vitas-M small molecule compound
(3S)-14-(benzyloxy)-16-hydroxy-3-methyl-3,4,5,6,9,10,11,12-octahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
Catalog ID
STL536802
SMILES O=C1CCCCCc2cc(OCc3ccccc3)cc(c2C(=O)O[C@H](CCC1)C)O
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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 C25H30O5 MW 410.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30O5/c1-18-9-8-14-21(26)13-7-3-6-12-20-15-22(16-23(27)24(20)25(28)30-18)29-17-19-10-4-2-5-11-19/h2,4-5,10-11,15-16,18,27H,3,6-9,12-14,17H2,1H3/t18-/m0/s1InChIKey
CIYDTLLVDXPDQI-SFHVURJKSA-NSynonyms
1212410-61-1(3S)14(benzyloxy)16hydroxy3methyl34569101112octahydro1H2benzoxacyclotetradecine17(8H)dione
(4~(S))18hydroxy4methyl16phenylmethoxy3oxabicyclo(1240)octadeca1(14)1517triene28dione
(S)14(benzyloxy)16hydroxy3methyl34569101112octahydro1Hbenzo(c)(1)oxacyclotetradecine17(8H)dione
1212410611
7088279
InChI=1SC25H30O5c118981421(26)1373612201522(1623(27)24(20)25(28)3018)291719104251119h245101115161827H369121417H21H3t18m0s1
MFCD04146305
O=C1CCCCCc2cc(OCc3ccccc3)cc(c2C(=O)O(C@H)(CCC1)C)O
ZINC000004064556
ZINC4064556
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