2-[2-[[(2S)-2-acetamido-3-[[(5'R)-2',5',7'-trimethyl-5'-oxidanyl-4'-oxidanylidene-spiro[cyclopropane-1,6'-indene]-1'-yl]methylsulfanyl]propanoyl]amino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[[(2S)-2-acetamido-3-[[(5'R)-2',5',7'-trimethyl-5'-oxidanyl-4'-oxidanylidene-spiro[cyclopropane-1,6'-indene]-1'-yl]methylsulfanyl]propanoyl]amino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[(2S)-2-acetamido-3-[[(5'R)-5'-hydroxy-2',5',7'-trimethyl-4'-oxo-spiro[cyclopropane-1,6'-indene]-1'-yl]methylsulfanyl]propanoyl]amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[(2S)-2-acetamido-3-[[(5'R)-5'-hydroxy-2',5',7'-trimethyl-4'-oxo-1'-spiro[cyclopropane-1,6'-indene]yl]methylthio]-1-oxopropyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[[(2S)-2-acetamido-3-[[(5'R)-5'-hydroxy-2',5',7'-trimethyl-4'-oxospiro[cyclopropane-1,6'-indene]-1'-yl]methylsulfanyl]propanoyl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[(2S)-2-acetamido-3-[[(5'R)-5'-hydroxy-4'-keto-2',5',7'-trimethyl-spiro[cyclopropane-1,6'-indene]-1'-yl]methylthio]propanoyl]amino]acetyl]amino]acetic acid Formula: C24H31N3O7S MolecularWeight: 505.58384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C3(CC3)C(C(=O)C2=C1)(C)O)C)CSCC(C(=O)NCC(=O)NCC(=O)O)NC(=O)C

Isomeric SMILES

CC1=C(C2=C(C3(CC3)[C@@](C(=O)C2=C1)(C)O)C)CSC[C@H](C(=O)NCC(=O)NCC(=O)O)NC(=O)C

InChI

InChI=1S/C24H31N3O7S/c1-12-7-15-20(13(2)24(5-6-24)23(4,34)21(15)32)16(12)10-35-11-17(27-14(3)28)22(33)26-8-18(29)25-9-19(30)31/h7,17,34H,5-6,8-11H2,1-4H3,(H,25,29)(H,26,33)(H,27,28)(H,30,31)/t17-,23+/m1/s1