Vitas-M small molecule compound
N-[({[(3E,8xi,9xi,14xi,17beta)-11,17-dihydroxy-17-methylandrost-4-en-3-ylidene]amino}oxy)acetyl]glycyltryptophan
Catalog ID
STL529081
SMILES O=C(NCC(=O)NC(C(=O)O)Cc1c[nH]c2c1cccc2)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2C(O)C[C@]2(C1CC[C@]2(C)O)C)C
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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 C35H46N4O7 MW 634.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H46N4O7/c1-33-12-10-22(15-21(33)8-9-24-25-11-13-35(3,45)34(25,2)16-28(40)31(24)33)39-46-19-30(42)37-18-29(41)38-27(32(43)44)14-20-17-36-26-7-5-4-6-23(20)26/h4-7,15,17,24-25,27-28,31,36,40,45H,8-14,16,18-19H2,1-3H3,(H,37,42)(H,38,41)(H,43,44)/bInChIKey
WSADXMODJOJOJD-FPVZCMNMSA-NSynonyms
2((2((2((~(E))((10~(R)13~(S)17~(S))1117dihydroxy101317trimethyl267891112141516decahydro1~(H)cyclopenta(a)phenanthren3ylidene)amino)oxyacetyl)amino)acetyl)amino)3(1~(H)indol3yl)propanoicacid
44662513
InChI=1SC35H46N4O7c133121022(1521(33)892425111335(345)34(252)1628(40)31(24)33)39461930(42)371829(41)3827(32(43)44)1420173626754623(20)26h4715172425272831364045H814161819H213H3(H3742)(H3841)(H4344)b3922+t24?25?27?28?31?333435m0s1
MFCD05733268
N(((((3E8xi9xi14xi17beta)1117dihydroxy17methylandrost4en3ylidene)amino)oxy)acetyl)glycyltryptophan
ZINC000253506678
ZINC000253506689
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