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Depiction
Upstream Precursor
NVGDLMUKSMHEQT-FRJWGUMJSA-N
Adenosine, N-(1-oxobutyl)-, cyclic 3',5'-(hydrogen phosphate)
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)[C@H]3[C@@H]([C@H]4[C@H](O3)COP…
Environmental
Depiction
Product
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Depiction
Upstream Precursor
CJGYSWNGNKCJSB-UHFFFAOYSA-N
6-(6-Butanamido-9H-purin-9-yl)-2-hydroxy-2-oxotetrahydro-2H,4H-2lambda~5~-furo(3,2-d)(1,3,2)dioxaphosphinin-7-yl butanoate
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C4C(O3)COP(=O)(O4)O)OC(=O)CCC
Abiotic
Depiction
Product
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Depiction
Upstream Precursor
CJGYSWNGNKCJSB-UHFFFAOYSA-N
6-(6-Butanamido-9H-purin-9-yl)-2-hydroxy-2-oxotetrahydro-2H,4H-2lambda~5~-furo(3,2-d)(1,3,2)dioxaphosphinin-7-yl butanoate
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C4C(O3)COP(=O)(O4)O)OC(=O)CCC
PriorBiotransformation
Depiction
Product
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O

Previewing top 3 entries. If you want the full results, please use the download button above.

Depiction
Precursor
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Environmental
Depiction
Downstream Successor
QTBSBXVTEAMEQO-UHFFFAOYSA-N
Acetic Acid
CC(=O)O
Depiction
Precursor
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Abiotic
Depiction
Downstream Successor
AEMRFAOFKBGASW-UHFFFAOYSA-N
Glycolic Acid
C(=O)(CO)O
Depiction
Precursor
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Environmental
Depiction
Downstream Successor
AEMRFAOFKBGASW-UHFFFAOYSA-N
Glycolic Acid
C(=O)(CO)O
Depiction
Precursor
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Environmental
Depiction
Downstream Successor
FERIUCNNQQJTOY-UHFFFAOYSA-N
Butyric Acid
C(CCC)(O)=O
Depiction
Precursor
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Abiotic
Depiction
Downstream Successor
FERIUCNNQQJTOY-UHFFFAOYSA-N
Butyric Acid
C(CCC)(O)=O
Depiction
Precursor
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Abiotic
Depiction
Downstream Successor
FERIUCNNQQJTOY-UHFFFAOYSA-N
Butyric Acid
C(CCC)(O)=O
Depiction
Precursor
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Environmental
Depiction
Downstream Successor
FERIUCNNQQJTOY-UHFFFAOYSA-N
Butyric Acid
C(CCC)(O)=O
Depiction
Precursor
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Environmental
Depiction
Downstream Successor
GFFGJBXGBJISGV-UHFFFAOYSA-N
Adenine
NC1=C2C(=NC=N1)NC=N2
Depiction
Precursor
XGJIHEKDLIOUQL-UHFFFAOYSA-N
{[(2R,3S,4R,5R)-5-(6-butanamido-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}phosphonic acid
CCCC(=O)NC1=C2C(=NC=N1)N(C=N2)C3C(C(C(O3)COP(=O)(O)O)O)O
Abiotic
Depiction
Downstream Successor
GFFGJBXGBJISGV-UHFFFAOYSA-N
Adenine
NC1=C2C(=NC=N1)NC=N2

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No Original Precursors

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No Dead-Ends

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