input word = C00023089

Metabolite InformationStructural formula
Name Sarcinene
2,2'-Bis(3-methyl-2-butenyl)-epsilon,epsilon-carotene
Formula C50H72
Mw 672.5634023
CAS RN 79490-05-4
C_ID C00023089 ,
InChIKey NTGKQTNJZISUML-AEHCAHAENA-N
InChICode InChI=1S/C50H72/c1-37(2)25-31-45-33-29-43(9)47(49(45,11)12)35-27-41(7)23-17-21-39(5)19-15-16-20-40(6)22-18-24-42(8)28-36-48-44(10)30-34-46(50(48,13)14)32-26-38(3)4/h15-30,35-36,45-48H,31-34H2,1-14H3/b16-15+,21-17+,22-18+,35-27+,36-28+,39-19+,40-20+,41-23+,42-24+/t45-,46+,47-,48+
SMILES [C@@H]1(/C=C/C(=C/C=C/C(=C/C=C/C=C(/C=C/C=C(/C=C/[C@H]2C([C@@H](CC=C2C)CC=C(C)C)(C)C)\C)\C)/C)/C)C([C@H](CC=C1C)CC=C(C)C)(C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
BacteriaCorynebacteriaceaeCorynebacterium glutamicum Ref.
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