Name: | CROCIN |
CAS: | 42553-65-1 ;94238-00-3 |
Synonyms: | CROCETIN DIGENTIOBIOSE ESTER ; CROCIN ; Α-CROCIN ; CROCIN I ; CROCETIN DIGENTIOBIOSYL ESTER ; B-D-GLUCOPYRANOSE, 6-O-D-GLUCOPYRANOSYL-, 1,1'-[(ALL-E)-2,6,11,15-TETRAMETHYL-2,4,6,8,10,12,14-HEXADECAHEPTAENEDIOATE] ; GARDENIA YELLOW ; ALPHA-CROCIN ; BETA-D-GLUCOPYRANOSE, 6-O-BETA-D-GLUCOPYRANOSYL-, 1,1'-[(2E,4E,6E,8E,10E,12E,14E)-2,6,11,15-TETRAMETHYL-2,4,6,8,10,12,14-HEXADECAHEPTAENEDIOATE] ; 8,8'-DIAPO-Y,Y-CAROTENEDIOIC ACID BIS(6-O-BETA-D-GLUCOPYRANOSYL-BETA-D-GLUCOPYRANOSYL) ESTER ; GARDENIA YELLOW, 98% BY HPLC ; CROCETIN DIGENTIBIOSE ESTER ; SAFFRON |
MDL.: | MFCD00017495 |
H bond acceptor: | 24 |
H bond donor: | 14 |
Smile: | C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C(=O)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)O)O)O)/C=C/C=C(/C)\C(=O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O)O |
InChi: | 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 |
InChiKey: | InChIKey=SEBIKDIMAPSUBY-AUBKFWJSSA-N |
Property |
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Melting Point: | 186℃ |
Specification: | STANDARD GRADE |
Safety information |
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WGK Germany: | 3 |
CROCIN
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