input word = C00023084

Metabolite InformationStructural formula
Name C.p. 473 glucoside
(2R,2'S)-3',4'-Didehydro-1',2'-dihydro-2-[(2E)-4-(beta-D-glucopyranosyloxy)-3-methyl-2-butenyl]-1'-hydroxy-2'-(3-methyl-2-butenyl)-beta,psi-carotene
Formula C56H82O7
Mw 866.60605497
CAS RN 267008-22-0
C_ID C00023084 ,
InChIKey LGDWPFWIHIKTNI-BJKZQYQENA-N
InChICode InChI=1S/C56H82O7/c1-39(2)27-32-48(56(12,13)61)34-28-43(6)25-18-24-42(5)23-16-21-40(3)19-14-15-20-41(4)22-17-26-44(7)30-36-49-46(9)31-35-47(55(49,10)11)33-29-45(8)38-62-54-53(60)52(59)51(58)50(37-57)63-54/h14-30,34,36,47-48,50-54,57-61H,31-33,35,37-38H2,1-13H3/b15-14+,21-16+,22-17+,24-18+,34-28+,36-30+,40-19+,41-20+,42-23+,43-25+,44-26+,45-29+/t47-,48-,50+,51-,52-,53+,54+/m0/s1
SMILES C1(=C(CC[C@@H](C1(C)C)C/C=C(/CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)\C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C=C(/C=C/[C@@H](C(C)(O)C)CC=C(C)C)\C)\C)\C)/C)/C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaMicrobacteriaceaeCurtobacterium flaccumfaciens pv. poinsettiae Ref.
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