Vitas-M small molecule compound
S-benzyl-N-[(6'-methyl-8'-oxo-3',4'-dihydro-8'H-spiro[cyclohexane-1,2'-pyrano[3,2-g]chromen]-7'-yl)acetyl]-L-cysteine
Catalog ID
STK575566
SMILES O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2)N[C@H](C(=O)O)CSCc1ccccc1
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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 C30H33NO6S MW 535.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33NO6S/c1-19-22-14-21-10-13-30(11-6-3-7-12-30)37-25(21)16-26(22)36-29(35)23(19)15-27(32)31-24(28(33)34)18-38-17-20-8-4-2-5-9-20/h2,4-5,8-9,14,16,24H,3,6-7,10-13,15,17-18H2,1H3,(H,31,32)(H,33,34)/t24-/m0/s1InChIKey
LZCRULVYFYIYAI-DEOSSOPVSA-NSynonyms
1014023-20-1(2R)3benzylsulfanyl2((2(6methyl8oxospiro(34dihydropyrano(32g)chromene21cyclohexane)7yl)acetyl)amino)propanoicacid
(R)3(benzylthio)2(2(6methyl8oxo48dihydro3Hspiro(cyclohexane12pyrano(32g)chromen)7yl)acetamido)propanoicacid
1014023201
CC1=C(C(=O)OC2=CC3=C(CCC4(O3)CCCCC4)C=C12)CC(=O)NC(CSCC5=CC=CC=C5)C(=O)O
InChI=1SC30H33NO6Sc119221421101330(116371230)3725(21)1626(22)3629(35)23(19)1527(32)3124(28(33)34)183817208425920h24589141624H3671013151718H21H3(H3132)(H3334)t24m0s1
MFCD18158076
O=C(Cc1c(=O)oc2c(c1C)cc1c(c2)OC2(CC1)CCCCC2)N(C@H)(C(=O)O)CSCc1ccccc1
SbenzylN((6methyl8oxo34dihydro8Hspiro(cyclohexane12pyrano(32g)chromen)7yl)acetyl)Lcysteine
ZINC000101367729
ZINC101367729
Check stock
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Check stock on Vitas-MAvailable files
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