Search More · GCI-TPs

Graphs show a maximum of 100 compounds. Use downloads for complete results.

Upstream Precursor

ZESRJSPZRDMNHY-UHFFFAOYSA-N

21-Hydroxypregn-4-ene-3,20-dione

CC12CCC3C(C1CCC2C(=O)CO)CCC4=CC(=O)CCC34C

Environmental

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Upstream Precursor

WPQKMAWYKDSBAX-XLQNIAEWSA-N

Desoxycorticosterone phenylpropionate

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)COC(=O)CCC4=CC=CC=C…

Abiotic

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Upstream Precursor

WPQKMAWYKDSBAX-XLQNIAEWSA-N

Desoxycorticosterone phenylpropionate

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)COC(=O)CCC4=CC=CC=C…

PriorBiotransformation

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Upstream Precursor

VPGRYOFKCNULNK-UHFFFAOYSA-N

3,20-Dioxopregn-4-en-21-yl acetate

CC(=O)OCC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C

Abiotic

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Upstream Precursor

VPGRYOFKCNULNK-UHFFFAOYSA-N

3,20-Dioxopregn-4-en-21-yl acetate

CC(=O)OCC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C

Environmental

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Upstream Precursor

VPGRYOFKCNULNK-UHFFFAOYSA-N

3,20-Dioxopregn-4-en-21-yl acetate

CC(=O)OCC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C

Environmental

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Upstream Precursor

YYGHYPOZSPWGOH-UHFFFAOYSA-N

17-(2-Chloro-acetyl)-10,13-dimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one

C(C(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)Cl

Abiotic

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Upstream Precursor

YYGHYPOZSPWGOH-UHFFFAOYSA-N

17-(2-Chloro-acetyl)-10,13-dimethyl-1,2,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one

C(C(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)Cl

Environmental

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Upstream Precursor

NLKIYMWKTGGEFS-UHFFFAOYSA-N

C(C(=O)OCC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)Cl

Abiotic

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Upstream Precursor

NLKIYMWKTGGEFS-UHFFFAOYSA-N

C(C(=O)OCC(=O)C1CCC2C1(CCC3C2CCC4=CC(=O)CCC34C)C)Cl

Environmental

Product

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Previewing top 10 entries. If you want the full results, please use the download button above.

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Abiotic

Downstream Successor

LWKCHEXQYCMNME-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoacetic acid

CC12CCC3C(C1CCC2C(=O)C(=O)O)CCC4=CC(=O)CCC34C

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Environmental

Downstream Successor

LWKCHEXQYCMNME-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxoacetic acid

CC12CCC3C(C1CCC2C(=O)C(=O)O)CCC4=CC(=O)CCC34C

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Abiotic

Downstream Successor

ACZXVRBVSIYLFQ-UHFFFAOYSA-N

C(C(=O)C1CCC2C1(CCC3C2CCC3(C4=CC(=O)CC4)C)C)=O

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Abiotic

Downstream Successor

LDDZHBUEONRXPK-UHFFFAOYSA-N

C(C(=O)C1CCC2C1(CCC3C2CCC45C(C(=O)CC4)C35C)C)=O

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Abiotic

Downstream Successor

NLXHQYRDBQQOEO-UHFFFAOYSA-N

C(C(=O)C1CCC2C1(CCC3C2CCC4(CC(=O)CC4)C3(C)O)C)=O

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Abiotic

Downstream Successor

CKJGTRHCGUQBPJ-UHFFFAOYSA-N

O=C(C(=O)C1CCC2C1(CCC3C2CCC3(C4=CC(=O)CC4)C)C)O

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Environmental

Downstream Successor

CKJGTRHCGUQBPJ-UHFFFAOYSA-N

O=C(C(=O)C1CCC2C1(CCC3C2CCC3(C4=CC(=O)CC4)C)C)O

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Abiotic

Downstream Successor

WUAYLVNHTNFAGQ-UHFFFAOYSA-N

O=C(C(=O)C1CCC2C1(CCC3C2CCC4(CC(=O)CC4)C3(C)O)C)O

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Environmental

Downstream Successor

WUAYLVNHTNFAGQ-UHFFFAOYSA-N

O=C(C(=O)C1CCC2C1(CCC3C2CCC4(CC(=O)CC4)C3(C)O)C)O

Precursor

FXJQDFFSUVVCMK-UHFFFAOYSA-N

2-(10,13-Dimethyl-3-oxo-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-17-yl)-2-oxo-acetaldehyde

CC12CCC3C(C1CCC2C(=O)C=O)CCC4=CC(=O)CCC34C

Abiotic

Downstream Successor

ZVQSUFPMMKLUNT-UHFFFAOYSA-N

O=C(C(=O)C1CCC2C1(CCC3C2CCC45C(C(=O)CC4)C35C)C)O

Previewing top 10 entries. If you want the full results, please use the download button above.

No Original Precursors

No entries were found for this section with the current query and depth.

No Dead-Ends

No entries were found for this section with the current query and depth.

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