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Substance Name: Hydroxysafflor yellow A
RN: 78281-02-4
InChIKey: LIPJRCGLQNIXGO-ONZBGLOFSA-N

Note

  • From Carthamus tinctorius.

Molecular Formula

  • C27-H32-O16

Molecular Weight

  • 612.534
 
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Names and Synonyms

Results Name

  • Hydroxysafflor yellow A

Name of Substance

  • Hydroxysafflor yellow A

Synonyms

  • Hydroxysafflor yellow A
  • Safflomin A

Systematic Name

  • 2,5-Cyclohexadien-1-one, 2,4-di-beta-D-glucopyranosyl-3,4,5-trihydroxy-6-((2E)-3-(4-hydroxyphenyl)-1-oxo-2-propenyl)-

Registry Numbers

CAS Registry Number

  • 78281-02-4

Other Registry Number

  • 146087-19-6

System Generated Number

  • 0078281024

Structure Descriptors

InChI

1S/C27H32O16/c28-7-12-16(32)19(35)21(37)23(42-12)15-18(34)14(11(31)6-3-9-1-4-10(30)5-2-9)24(39)27(41,25(15)40)26-22(38)20(36)17(33)13(8-29)43-26/h1-6,12-13,16-17,19-23,26,28-30,32-33,35-41H,7-8H2/b6-3+/t12-,13-,16-,17-,19+,20+,21-,22-,23+,26-,27?/m1/s1

InChIKey

LIPJRCGLQNIXGO-ONZBGLOFSA-N

Smiles

C1(C(=C([C@@](C(=C1C(\C=C\c1ccc(cc1)O)=O)O)(O)[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)O)[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO)=O