methyl 3-[[6-[[(3S)-3-ethanoyl-10-methoxy-3,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-2,4-dihydro-1H-tetracen-1-yl]oxy]-2-methyl-3-oxidanyl-oxan-4-yl]amino]but-2-enoate

Systemtic Name: methyl 3-[[6-[[(3S)-3-ethanoyl-10-methoxy-3,5,12-tris(oxidanyl)-6,11-bis(oxidanylidene)-2,4-dihydro-1H-tetracen-1-yl]oxy]-2-methyl-3-oxidanyl-oxan-4-yl]amino]but-2-enoate Openeye Name: methyl 3-[[6-[[(3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]amino]but-2-enoate CAS Name: 3-[[6-[[(3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-4-oxanyl]amino]-2-butenoic acid methyl ester IUPAC Name: methyl 3-[[6-[[(3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]amino]but-2-enoate Traditional Name: 3-[[6-[[(3S)-3-acetyl-3,5,12-trihydroxy-6,11-diketo-10-methoxy-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyl-tetrahydropyran-4-yl]amino]but-2-enoic acid methyl ester Formula: C32H35NO12 MolecularWeight: 625.6198

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(CC(O1)OC2CC(CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NC(=CC(=O)OC)C)O

Isomeric SMILES

CC1C(C(CC(O1)OC2C[C@@](CC3=C(C4=C(C(=C23)O)C(=O)C5=C(C4=O)C=CC=C5OC)O)(C(=O)C)O)NC(=CC(=O)OC)C)O

InChI

InChI=1S/C32H35NO12/c1-13(9-21(35)43-5)33-18-10-22(44-14(2)27(18)36)45-20-12-32(41,15(3)34)11-17-24(20)31(40)26-25(29(17)38)28(37)16-7-6-8-19(42-4)23(16)30(26)39/h6-9,14,18,20,22,27,33,36,38,40-41H,10-12H2,1-5H3/t14?,18?,20?,22?,27?,32-/m0/s1