Identification |
Name: | [2,9'-Bianthracene]-4',8(1'H,5H)-dione,2',3',6,7-tetrahydro-1,2',5',6,9,10'-hexahydroxy-2',6-dimethyl-, (2S,2'S,6R)-(9CI) |
Synonyms: | Diast T514; Peroxisomicin A2; Peroxisomicine A2; T 514' |
CAS: | 156768-16-0 |
Molecular Formula: | C30H26 O8 |
Molecular Weight: | 514.56 |
InChI: | InChI=1/C30H26O8/c1-29(37)9-14-8-13-6-7-16(26(34)22(13)27(35)21(14)19(32)11-29)23-15-4-3-5-18(31)24(15)28(36)25-17(23)10-30(2,38)12-20(25)33/h3-8,31,34-38H,9-12H2,1-2H3/t29-,30+/m0/s1 |
Molecular Structure: |
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Properties |
Flash Point: | 467.3°C |
Boiling Point: | 826.1°C at 760 mmHg |
Density: | 1.539g/cm3 |
Refractive index: | 1.78 |
Specification: |
Descriptors computed from structure, you can know some information about Peroxisomicine a2 (CAS NO.156768-16-0) :
Canonical SMILES: CC1(CC2=C(C(=O)C1)C(=C3C(=C2)C=CC(=C3O)C4=C5CC(CC(=O)C5=C(C6=C4C=CC=C6O)O)(C)O)O)O
Isomeric SMILES: C[C@@]1(CC2=C(C(=O)C1)C(=C3C(=C2)C=CC(=C3O)C4=C5C[C@@](CC(=O)C5=C(C6=C4C=CC=C6O)O)(C)O)O)O
InChI: InChI=1S/C30H26O8/c1-29(37)9-14-8-13-6-7-16(26(34)22(13)27(35)21(14)19(32)11-29)23-15-4-3-5-18(31)24(15)28(36)25-17(23)10-30(2,38)12-20(25)33/h3-8,31,34-38H,9-12H2,1-2H3/t29-,30+/m0/s1
InChIKey: FBPZAGOTWAVQJH-XZWHSSHBSA-N
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Flash Point: | 467.3°C |
Safety Data |
Hazard Symbols |
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