Acids

Cas#: 77-06-5        Compound CID:  6466

Formula:  C₁₉H₂₂O₆        Molecular Weight: 346.37

IUPAC Name: (1R,2R,5S,8S,9S,10R,11S,12S)-5,12-dihydroxy-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid

SMILES: CC12C(C=CC3(C1C(C45C3CCC(C4)(C(=C)C5)O)C(=O)O)OC2=O)O

InChIKey: IXORZMNAPKEEDV-OBDJNFEBSA-N

InChI: InChI=1S/C19H22O6/c1-9-7-17-8-18(9,24)5-3-10(17)19-6-4-11(20)16(2,15(23)25-19)13(19)12(17)14(21)22/h4,6,10-13,20,24H,1,3,5,7-8H2,2H3,(H,21,22)/t10-,11+,12-,13-,16-,17+,18+,19-/m1/s1

Cas#: 121-57-3        Compound CID:  8479

Formula:  C₆H₇NO₃S        Molecular Weight: 173.19

IUPAC Name: 4-aminobenzenesulfonic acid

SMILES: C1=CC(=CC=C1N)S(=O)(=O)O

InChIKey: HVBSAKJJOYLTQU-UHFFFAOYSA-N

InChI: InChI=1S/C6H7NO3S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H,8,9,10)

Cas#: 97-67-6        Compound CID:  222656

Formula:  C₄H₆O₅        Molecular Weight: 134.09

IUPAC Name: (2S)-2-hydroxybutanedioic acid

SMILES: C(C(C(=O)O)O)C(=O)O

InChIKey: BJEPYKJPYRNKOW-REOHCLBHSA-N

InChI: InChI=1S/C4H6O5/c5-2(4(8)9)1-3(6)7/h2,5H,1H2,(H,6,7)(H,8,9)/t2-/m0/s1

Cas#: 1333-82-0(water)       

Formula:        

Cas#: 1333-82-0(water)       

Formula:        

Cas#: 69-72-7        Compound CID:  338

Formula:  C₇H₆O₃        Molecular Weight: 138.12

IUPAC Name: 2-hydroxybenzoic acid

SMILES: C1=CC=C(C(=C1)C(=O)O)O

InChIKey: YGSDEFSMJLZEOE-UHFFFAOYSA-N

InChI: InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10)

Cas#: 13598-36-2        Compound CID:  3084169

Formula:  H₃PO₃        Molecular Weight: 82.00

Cas#: 139-13-9        Compound CID:  8758

Formula:  C₆H₉NO₆        Molecular Weight: 191.14

IUPAC Name: 2-[bis(carboxymethyl)amino]acetic acid

SMILES: C(C(=O)O)N(CC(=O)O)CC(=O)O

InChIKey: MGFYIUFZLHCRTH-UHFFFAOYSA-N

InChI: InChI=1S/C6H9NO6/c8-4(9)1-7(2-5(10)11)3-6(12)13/h1-3H2,(H,8,9)(H,10,11)(H,12,13)

Cas#: 110-16-7        Compound CID:  444266

Formula:  C₄H₄O₄        Molecular Weight: 116.07

IUPAC Name: (Z)-but-2-enedioic acid

SMILES: C(=CC(=O)O)C(=O)O

InChIKey: VZCYOOQTPOCHFL-UPHRSURJSA-N

InChI: InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1-

Cas#: 544-63-8        Compound CID:  11005

Formula:  C₁₄H₂₈O₂        Molecular Weight: 228.37

IUPAC Name: tetradecanoic acid

SMILES: CCCCCCCCCCCCCC(=O)O

InChIKey: TUNFSRHWOTWDNC-UHFFFAOYSA-N

InChI: InChI=1S/C14H28O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h2-13H2,1H3,(H,15,16)

Cas#: 64-19-7(water)       

Formula:  CH₃CO₂H        Molecular Weight: 60.05

Cas#: 10450-60-9        Compound CID:  25289

Formula:  H₅IO₆        Molecular Weight: 227.94

IUPAC Name: pentahydroxy(oxo)-λ7-iodane

SMILES: OI(=O)(O)(O)(O)O

InChIKey: TWLXDPFBEPBAQB-UHFFFAOYSA-N

InChI: InChI=1S/H5IO6/c2-1(3,4,5,6)7/h(H5,2,3,4,5,6,7)