(Q110077568)

English

2-(Hydroxymethyl)-6-[3,5,5-trimethyl-4-[3,7,12,16-tetramethyl-18-[2,6,6-trimethyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexen-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-3-en-1-yl]oxyoxane-3,4,5-triol

group of stereoisomers with the chemical formula C₅₂H₇₆O₁₂

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Statements

instance of

group of stereoisomers

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subclass of

chemical compound

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mass

892.533677872 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₅₂H₇₆O₁₂

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canonical SMILES

OCC1OC(OC2CC(=C(C=CC(=CC=CC(=CC=CC=C(C=CC=C(C=CC3=C(C)CC(OC4OC(CO)C(O)C(O)C4O)CC3(C)C)C)C)C)C)C(C)(C)C2)C)C(O)C(O)C1O

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found in taxon

Pantoea ananatis

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stated in

Functional assignment of Erwinia herbicola Eho10 carotenoid genes expressed in Escherichia coli

Pantoea agglomerans

1 reference

stated in

Elucidation of the Erwinia uredovora carotenoid biosynthetic pathway by functional analysis of gene products expressed in Escherichia coli

Identifiers

InChI

InChI=1S/C52H76O12/c1-31(17-13-19-33(3)21-23-39-35(5)25-37(27-51(39,7)8)61-49-47(59)45(57)43(55)41(29-53)63-49)15-11-12-16-32(2)18-14-20-34(4)22-24-40-36(6)26-38(28-52(40,9)10)62-50-48(60)46(58)44(56)42(30-54)64-50/h11-24,37-38,41-50,53-60H,25-30H2,1-10H3

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InChIKey

DHNSFMNURMJEQV-UHFFFAOYSA-N

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2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

DHNSFMNURMJEQV-UHFFFAOYSA-N

(Q110077568)

2-(Hydroxymethyl)-6-[3,5,5-trimethyl-4-[3,7,12,16-tetramethyl-18-[2,6,6-trimethyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycyclohexen-1-yl]octadeca-1,3,5,7,9,11,13,15,17-nonaenyl]cyclohex-3-en-1-yl]oxyoxane-3,4,5-triol

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Identifiers

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