Cas no 53178-29-3 (Crocin A)

Crocin A structure
Crocin A structure
Product Name:Crocin A
CAS No:53178-29-3
MF:C44H64O24
MW:976.96
CID:4757140
Update Time:2022-10-26

Crocin A Chemical and Physical Properties

Names and Identifiers

    • Crocin A
    • Inchi： 1S/C44H64O24/c1-19(11-7-13-21(3)39(59)67-43-37(57)33(53)29(49)25(65-43)17-61-41-35(55)31(51)27(47)23(15-45)63-41)9-5-6-10-20(2)12-8-14-22(4)40(60)68-44-38(58)34(54)30(50)26(66-44)18-62-42-36(56)32(52)28(48)24(16-46)64-42/h5-14,23-38,41-58H,15-18H2,1-4H3/b6-5+,11-7+,12-8+,19-9+,20-10+,21-13+,22-14+/t23-,24-,25-,26-,27-,28-,29-,30-,31+,32+,33+,34+,35-,36-,37-,38-,41-,42-,43+,44+/m1/s1
    • InChI Key： SEBIKDIMAPSUBY-RTJKDTQDSA-N
    • SMILES： [C@H]1([C@H](O[C@H]([C@H](O)[C@H]1O)OC[C@@H]1[C@H]([C@H](O)[C@@H](O)[C@H](OC(=O)/C(/C)=C/C=C/C(/C)=C/C=C/C=C(\C)/C=C/C=C(\C)/C(O[C@@H]2O[C@@H]([C@H]([C@H](O)[C@H]2O)O)CO[C@@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)=O)O1)O)CO)O

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