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Depiction
Upstream Precursor
LUZRJRNZXALNLM-UHFFFAOYSA-N
Dihydroegotamine
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CN(C6CC…
Depth 1
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depiction
Upstream Precursor
XCGSFFUVFURLIX-VFGNJEKYSA-N
Ergotamine
C[C@@]1(C(=O)N2[C@H](C(=O)N3CCC[C@H]3[C@@]2(O1)O)CC4=CC=CC=C4…
Depth 1
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depiction
Upstream Precursor
QNJVWAHQHRXJBE-UHFFFAOYSA-N
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CC6C(CC…
Depth 1
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depiction
Upstream Precursor
RUDMYNQFUFZHMD-UHFFFAOYSA-N
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CC6C(CC…
Depth 1
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depiction
Upstream Precursor
KHGNWXUEJGDUQA-UHFFFAOYSA-N
CC1(C(=O)N2C(C(=O)[N+]3(CCCC3C2(O1)O)[O-])CC4=CC=CC=C4)NC(=O)…
Depth 2
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depiction
Upstream Precursor
UTTHQILZAUJIQD-UHFFFAOYSA-N
CC1(C(=O)[N+]2(C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)[O-])NC(=O)…
Depth 2
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depiction
Upstream Precursor
AVVFHTBSWWBSQB-UHFFFAOYSA-N
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CC6C(CC…
Depth 1
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depiction
Upstream Precursor
OBBAYYAHTCMGLQ-UHFFFAOYSA-O
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CC6C(CC…
Depth 1
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depiction
Upstream Precursor
AXQHJDZSNBUSKE-UHFFFAOYSA-N
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5CC6(C(C…
Depth 1
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depiction
Upstream Precursor
HYJASOSQYCQANJ-UHFFFAOYSA-N
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)NC(=O)C5(CC6C(C…
Depth 1
Depiction
Product
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N

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

Depiction
Precursor
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depth 2
Depiction
Downstream Successor
VOXXWSYKYCBWHO-UHFFFAOYSA-N
(+-)-3-Phenyllactic acid
C1=CC=C(C=C1)CC(C(=O)O)O
Depiction
Precursor
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depth 3
Depiction
Downstream Successor
PAFLSMZLRSPALU-UHFFFAOYSA-N
3-(3,4-Dihydroxyphenyl)-2-hydroxypropanoic acid
C(C(C(=O)O)O)C1=CC(O)=C(C=C1)O
Depiction
Precursor
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depth 3
Depiction
Downstream Successor
JVGVDSSUAVXRDY-UHFFFAOYSA-N
(+-)-3-(4-Hydroxyphenyl)lactic acid
C(C(=O)O)(CC1=CC=C(C=C1)O)O
Depiction
Precursor
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depth 3
Depiction
Downstream Successor
BTNMPGBKDVTSJY-UHFFFAOYSA-N
Phenylpyruvic acid
OC(=O)C(CC1=CC=CC=C1)=O
Depiction
Precursor
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depth 3
Depiction
Downstream Successor
GTWPCOXXRVFOCJ-UHFFFAOYSA-N
3-(2,3-Dihydroxyphenyl)-2-hydroxypropanoic acid
C(C(C(=O)O)O)C1=CC=CC(O)=C1O
Depiction
Precursor
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depth 1
Depiction
Downstream Successor
CLQBGCYCKBRTCY-UHFFFAOYSA-N
CC1(C(=O)N(C(C(=O)O)CC2=CC=CC=C2)C(C3CCCN3)(O1)O)N
Depiction
Precursor
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depth 1
Depiction
Downstream Successor
YFZUKYHFGNCOLL-UHFFFAOYSA-N
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=C(C=C4)O)N
Depiction
Precursor
YHMWLYYXMIFGNR-UHFFFAOYSA-N
4-Amino-7-benzyl-2-hydroxy-4-methyl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecane-5,8-dione
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4=CC=CC=C4)N
Depth 1
Depiction
Downstream Successor
YTQAWJGBRSOXFH-UHFFFAOYSA-N
CC1(C(=O)N2C(C(=O)N3CCCC3C2(O1)O)CC4C=CC(=O)C=C4)N

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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