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Substance Name: Benzoic acid, 2-(acetyloxy)-, 2-(3,4-bis((2-(acetyloxy)benzoyl)oxy)phenyl)-4-oxo-4H-1-benzopyran-3,5,7-triyl ester
RN: 110414-69-2
InChIKey: ZSKZFQKDKHRALK-UHFFFAOYSA-N

Molecular Formula

  • C60-H40-O22

Molecular Weight

  • 1112.95
 
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Names and Synonyms

  • Benzoic acid, 2-(acetyloxy)-, 2-(3,4-bis((2-(acetyloxy)benzoyl)oxy)phenyl)-4-oxo-4H-1-benzopyran-3,5,7-triyl ester

Registry Numbers

CAS Registry Number

  • 110414-69-2

System Generated Number

  • 0110414692

Structure Descriptors

InChI

1S/C60H40O22/c1-31(61)72-43-21-11-6-16-38(43)56(67)77-37-29-50-52(51(30-37)81-59(70)41-19-9-14-24-46(41)75-34(4)64)53(66)55(82-60(71)42-20-10-15-25-47(42)76-35(5)65)54(78-50)36-26-27-48(79-57(68)39-17-7-12-22-44(39)73-32(2)62)49(28-36)80-58(69)40-18-8-13-23-45(40)74-33(3)63/h6-30H,1-5H3

InChIKey

ZSKZFQKDKHRALK-UHFFFAOYSA-N

Smiles

c1(c(c(c2c(o1)cc(cc2OC(c1c(cccc1)OC(=O)C)=O)OC(c1c(cccc1)OC(=O)C)=O)=O)OC(c1c(cccc1)OC(=O)C)=O)c1cc(c(cc1)OC(c1c(cccc1)OC(=O)C)=O)OC(c1c(cccc1)OC(=O)C)=O