Vitas-M small molecule compound

6-({1-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-L-prolyl}amino)hexanoic acid

Catalog ID
STL533582
SMILES OC(=O)CCCCCNC(=O)[C@@H]1CCCN1C(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2

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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 C30H36N2O7 MW 536.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36N2O7/c1-18-19(30(37)39-25-17-26-22(16-21(18)25)20-8-4-5-10-24(20)38-26)12-13-27(33)32-15-7-9-23(32)29(36)31-14-6-2-3-11-28(34)35/h16-17,23H,2-15H2,1H3,(H,31,36)(H,34,35)/t23-/m0/s1
InChIKey
XARBQMJCQWUAMF-QHCPKHFHSA-N
Synonyms
956950-11-1
(S)6(1(3(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanoyl)pyrrolidine2carboxamido)hexanoicacid
16405439
6(((2~(S))1(3(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoyl)pyrrolidine2carbonyl)amino)hexanoicacid
6((1(3(4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)Lprolyl)amino)hexanoicacid
956950111
InChI=1SC30H36N2O7c11819(30(37)3925172622(1621(18)25)208451024(20)3826)121327(33)32157923(32)29(36)31146231128(34)35h161723H215H21H3(H3136)(H3435)t23m0s1
MFCD08002401
OC(=O)CCCCCNC(=O)(C@@H)1CCCN1C(=O)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
ZINC000070704581
ZINC70704581

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Available files

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