input word = C00023231

Metabolite InformationStructural formula
Name Isocryptoxanthin
beta,beta-Caroten-4-ol
Formula C40H56O
Mw 552.43311641
CAS RN 472-62-8
C_ID C00023231 ,
InChIKey JCRCKXUPYKELBT-QQGJMDNJNA-N
InChICode InChI=1S/C40H56O/c1-30(18-13-20-32(3)23-25-36-34(5)22-15-28-39(36,7)8)16-11-12-17-31(2)19-14-21-33(4)24-26-37-35(6)38(41)27-29-40(37,9)10/h11-14,16-21,23-26,38,41H,15,22,27-29H2,1-10H3/b12-11+,18-13+,19-14+,25-23+,26-24+,30-16+,31-17+,32-20+,33-21+/t38-/m1/s1
SMILES C1C[C@H](C(=C(C1(C)C)/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/C1=C(CCCC1(C)C)C)\C)\C)/C)/C)C)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeCorbiculidaeCorbicula japonica Ref.
PlantaeCorbiculidaeCorbicula sandai Ref.
--Cyanophyta sp. Ref.
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