2-[[2-[[2-[(17-ethynyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-ylidene)amino]oxyacetyl]amino]-3-methyl-butanoyl]amino]-4-methylsulfanyl-butanoic acid
Molecular Formula:
C33H49N3O6S
InChI: InChI=1/C33H49N3O6S/c1-7-33(41)16-12-25-23-9-8-21-18-22(10-14-31(21,4)24(23)11-15-32(25,33)5)36-42-19-27(37)35-28(20(2)3)29(38)34-26(30(39)40)13-17-43-6/h1,18,20,23-26,28,41H,8-17,19H2,2-6H3,(H,34,38)(H,35,37)(H,39,40)/f/h34-35,39H
InChIKey: InChIKey=FRXNTGWAGPVGFD-QWZGGXJLCS
SMILES: CC(C)C(C(=O)NC(CCSC)C(=O)O)NC(=O)CON=C1CCC2(C3CCC4(C(C3CCC2=C1)CCC4(C#C)O)C)C
Names:
2-[[2-[[2-[(17-ethynyl-17-hydroxy-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-ylidene)amino]oxyacetyl]amino]-3-methyl-butanoyl]amino]-4-methylsulfanyl-butanoic acid
Registries:
PubChem CID 3540875
PubChem ID 4782853
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