Vitas-M small molecule compound
(3S,11E)-16-hydroxy-3-methyl-14-[(pentamethylbenzyl)oxy]-3,4,5,6,9,10-hexahydro-1H-2-benzoxacyclotetradecine-1,7(8H)-dione
Catalog ID
STL536511
SMILES O=C1CCC/C=C/c2cc(OCc3c(C)c(C)c(c(c3C)C)C)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 C30H38O5 MW 478.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H38O5/c1-18-11-10-14-25(31)13-9-7-8-12-24-15-26(16-28(32)29(24)30(33)35-18)34-17-27-22(5)20(3)19(2)21(4)23(27)6/h8,12,15-16,18,32H,7,9-11,13-14,17H2,1-6H3/b12-8+/t18-/m0/s1InChIKey
PAWIGCHVLAGHSR-HCWHUNCVSA-NSynonyms
(3S11E)16hydroxy3methyl14((pentamethylbenzyl)oxy)3456910hexahydro1H2benzoxacyclotetradecine17(8H)dione
(4~(S)12~(E))18hydroxy4methyl16((23456pentamethylphenyl)methoxy)3oxabicyclo(1240)octadeca1(14)121517tetraene28dione
(SE)16hydroxy3methyl14((23456pentamethylbenzyl)oxy)3456910hexahydro1Hbenzo(c)(1)oxacyclotetradecine17(8H)dione
16400968
InChI=1SC30H38O5c11811101425(31)1397812241526(1628(32)29(24)30(33)3518)34172722(5)20(3)19(2)21(4)23(27)6h81215161832H7911131417H216H3b128+t18m0s1
MFCD05672319
O=C1CCCC=Cc2cc(OCc3c(C)c(C)c(c(c3C)C)C)cc(c2C(=O)O(C@H)(CCC1)C)O
ZINC000254876518
ZINC12866932
Check stock
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