子结构搜索

2505

COc1ccc(C[C@H](C)O)cc1OC
Reaction #6696
(S)-1-(3,4-dimethoxyphenyl)-2-propanol
DOI: 10.6084/m9.figshare.5104873.v1
O=P([O-])([O-])[O-]
Reaction #7441
Phosphate
DOI: 10.6084/m9.figshare.5104873.v1
CCOC(=O)c1nc(NCC(c2ccccc2)c2ccccc2)c2ncn([C@@H]3O[C@H](C(=O)O)[C@H]4OC(C)(C)O[C@H]43)c2n1
Reaction #10565
title compound
DOI: 10.6084/m9.figshare.5104873.v1
CCNC(=O)[C@H]1O[C@@H](n2cnc3c(NCC(c4ccccc4)c4ccccc4)nc(C(=O)OCC)nc32)[C@@H]2OC(C)(C)O[C@@H]21
Reaction #10566
title compound
收率 78.9%DOI: 10.6084/m9.figshare.5104873.v1
CC(C)(C)C(=O)Nc1cnc([C@H](O)CO)cn1
Reaction #40279
(S)—N-[5-(1,2-dihydroxy-ethyl)-pyrazin-yl]-2,2-dimethyl-propionamide
收率 105.1%DOI: 10.6084/m9.figshare.5104873.v1
C[C@@](O)(CCO)CC(=O)[O-]
Reaction #42641
mevalonate
DOI: 10.6084/m9.figshare.5104873.v1
C/C(=C\c1csc(C)n1)[C@@H]1C[C@@H]2O[C@]2(C)CCC[C@H](C)[C@H](O)[C@@H](C)C(=O)C(C)(C)[C@@H](O)CC(=O)O1
Reaction #42642
epothilone B
DOI: 10.6084/m9.figshare.5104873.v1
Nc1nc(I)nc2c1ncn2[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H]1O
Reaction #44333
6.8
收率 85.0%DOI: 10.6084/m9.figshare.5104873.v1
NC(=O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.O=C[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO
Reaction #46041
NAD Glucose
DOI: 10.6084/m9.figshare.5104873.v1
OC1C(O)C(O)C(O)C(O)C1O
Reaction #48998
myo-inositol
DOI: 10.6084/m9.figshare.5104873.v1
OC1C(O)C(O)C(O)C(O)C1O
Reaction #48999
myo-inositol
DOI: 10.6084/m9.figshare.5104873.v1
C=CCO[C@H]1[C@@H](O)[C@H](n2cnc3c(N)ncnc32)O[C@@H]1CO
Reaction #51519
title compound
收率 66.0%DOI: 10.6084/m9.figshare.5104873.v1
C=CCO[C@H]1[C@@H](O)[C@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)O[C@@H]1CO
Reaction #51520
title compound
收率 62.0%DOI: 10.6084/m9.figshare.5104873.v1
C/C(=C\c1csc(C)n1)[C@@H]1C[C@@H]2O[C@]2(C)CCC[C@H](C)[C@H](O)[C@@H](C)C(=O)C(C)(C)[C@@H](O)CC(=O)O1
Reaction #53255
epothilone B
DOI: 10.6084/m9.figshare.5104873.v1
C[N+](C)(C)C[C@H](O)CC(=O)[O-]
Reaction #55853
L-carnitine
收率 27.0%DOI: 10.6084/m9.figshare.5104873.v1
C[N+](C)(C)CC(O)CC(=O)[O-]
Reaction #55854
Carnitine
DOI: 10.6084/m9.figshare.5104873.v1
C[N+](C)(C)C[C@H](O)CC(=O)[O-]
Reaction #55855
L-carnitine
收率 77.5%DOI: 10.6084/m9.figshare.5104873.v1
O=P(O)(O)OC[C@H]1O[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O
Reaction #55961
amitriptyline
DOI: 10.6084/m9.figshare.5104873.v1
CCCCOC(=O)C(O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
Reaction #56254
adenosine-5'-carboxylic acid n-butyl ester
收率 54.0%DOI: 10.6084/m9.figshare.5104873.v1
CCCCOC(=O)C(O)[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
Reaction #56255
crude product
收率 87.0%DOI: 10.6084/m9.figshare.5104873.v1
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