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Pyranopyridines

Pyranopyridines

Organic bicyclic compounds that consist of a pyran ring fused to a pyridine ring.
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1 – 10 of 10 results
1

Irinotecan hydrochloride trihydrate, Thermo Scientific Chemicals

CAS: 136572-09-3 Molecular Formula: HCl·3H2O Molecular Weight (g/mol): 677.18 InChI Key: KLEAIHJJLUAXIQ-JDRGBKBRSA-N Synonym: irinotecan hydrochloride trihydrate,irinotecan hcl trihydrate,cpt 11,unii-042laq1iis,campto,irinotecan hcl,042laq1iis,onivyde,cpt-11 PubChem CID: 60837 SMILES: CCC1=C2C=C(C=CC2=NC3=C1CN4C3=CC5=C(C4=O)COC(=O)C5(CC)O)OC(=O)N6CCC(CC6)N7CCCCC7.O.O.O.Cl

PubChem CID 60837
CAS 136572-09-3
Molecular Weight (g/mol) 677.18
SMILES CCC1=C2C=C(C=CC2=NC3=C1CN4C3=CC5=C(C4=O)COC(=O)C5(CC)O)OC(=O)N6CCC(CC6)N7CCCCC7.O.O.O.Cl
Synonym irinotecan hydrochloride trihydrate,irinotecan hcl trihydrate,cpt 11,unii-042laq1iis,campto,irinotecan hcl,042laq1iis,onivyde,cpt-11
InChI Key KLEAIHJJLUAXIQ-JDRGBKBRSA-N
Molecular Formula HCl·3H2O
2

7-Ethyl-10-hydroxycamptothecin, 98%, Thermo Scientific Chemicals

CAS: 86639-52-3 Molecular Formula: C22H20N2O5 Molecular Weight (g/mol): 392.4 InChI Key: FJHBVJOVLFPMQE-QFIPXVFZSA-N Synonym: 7-ethyl-10-hydroxycamptothecin,sn 38 lactone,7-ethyl-10-hydroxy-camptothecin,10-hydroxy-7-ethylcamptothecin,7-ethyl-10-hydroxycamptothecine,le-sn38,7-ethyl-10-hydroxy-20 s-camptothecin,captothecin, 7-ethyl-10-hydroxy,s-4,11-diethyl-4,9-dihydroxy-1h-pyrano 3',4':6,7 indolizino 1,2-b quinoline-3,14 4h,12h-dione,7-ethyl-10-hydroxy camptothecin PubChem CID: 104842 ChEBI: CHEBI:8988 SMILES: CCC1=C2C=C(C=CC2=NC3=C1CN4C3=CC5=C(C4=O)COC(=O)C5(CC)O)O

PubChem CID 104842
CAS 86639-52-3
Molecular Weight (g/mol) 392.4
ChEBI CHEBI:8988
SMILES CCC1=C2C=C(C=CC2=NC3=C1CN4C3=CC5=C(C4=O)COC(=O)C5(CC)O)O
Synonym 7-ethyl-10-hydroxycamptothecin,sn 38 lactone,7-ethyl-10-hydroxy-camptothecin,10-hydroxy-7-ethylcamptothecin,7-ethyl-10-hydroxycamptothecine,le-sn38,7-ethyl-10-hydroxy-20 s-camptothecin,captothecin, 7-ethyl-10-hydroxy,s-4,11-diethyl-4,9-dihydroxy-1h-pyrano 3',4':6,7 indolizino 1,2-b quinoline-3,14 4h,12h-dione,7-ethyl-10-hydroxy camptothecin
InChI Key FJHBVJOVLFPMQE-QFIPXVFZSA-N
Molecular Formula C22H20N2O5
3

(+)-Camptothecin, 98%, Thermo Scientific Chemicals

CAS: 7689-03-4 Molecular Formula: C20H16N2O4 Molecular Weight (g/mol): 348.35 MDL Number: MFCD00081076 InChI Key: VSJKWCGYPAHWDS-FQEVSTJZSA-N Synonym: camptothecin,camptothecine,s-+-camptothecin,campathecin,+-camptothecine,d-camptothecin,20 s-camptothecine,+-camptothecin,21,22-secocamptothecin-21-oic acid lactone,s-camptothecin PubChem CID: 24360 ChEBI: CHEBI:27656 SMILES: CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)O

PubChem CID 24360
CAS 7689-03-4
Molecular Weight (g/mol) 348.35
ChEBI CHEBI:27656
MDL Number MFCD00081076
SMILES CCC1(C2=C(COC1=O)C(=O)N3CC4=CC5=CC=CC=C5N=C4C3=C2)O
Synonym camptothecin,camptothecine,s-+-camptothecin,campathecin,+-camptothecine,d-camptothecin,20 s-camptothecine,+-camptothecin,21,22-secocamptothecin-21-oic acid lactone,s-camptothecin
InChI Key VSJKWCGYPAHWDS-FQEVSTJZSA-N
Molecular Formula C20H16N2O4
4

CPT 11, Tocris Bioscience™

CAS: 100286-90-6 Molecular Formula: C33H39ClN4O6 Molecular Weight (g/mol): 623.15 MDL Number: MFCD01862255 InChI Key: GURKHSYORGJETM-WAQYZQTGSA-N Synonym: irinotecan hydrochloride,irinotecan hcl,topotecin,campto,cpt-11,cpt 11,camptothecin 11 hydrochloride,camptothecin 11,unii-06x131e4oe PubChem CID: 74990 ChEBI: CHEBI:5971 IUPAC Name: hydrogen (19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-7-yl [1,4'-bipiperidine]-1'-carboxylate chloride SMILES: [H+].[Cl-].CCC1=C2C=C(OC(=O)N3CCC(CC3)N3CCCCC3)C=CC2=NC2=C1CN1C2=CC2=C(COC(=O)[C@]2(O)CC)C1=O

PubChem CID 74990
CAS 100286-90-6
Molecular Weight (g/mol) 623.15
ChEBI CHEBI:5971
MDL Number MFCD01862255
SMILES [H+].[Cl-].CCC1=C2C=C(OC(=O)N3CCC(CC3)N3CCCCC3)C=CC2=NC2=C1CN1C2=CC2=C(COC(=O)[C@]2(O)CC)C1=O
Synonym irinotecan hydrochloride,irinotecan hcl,topotecin,campto,cpt-11,cpt 11,camptothecin 11 hydrochloride,camptothecin 11,unii-06x131e4oe
IUPAC Name hydrogen (19S)-10,19-diethyl-19-hydroxy-14,18-dioxo-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2(11),3,5,7,9,15(20)-heptaen-7-yl [1,4'-bipiperidine]-1'-carboxylate chloride
InChI Key GURKHSYORGJETM-WAQYZQTGSA-N
Molecular Formula C33H39ClN4O6
5

Topotecan hydrochloride, Tocris Bioscience™

CAS: 119413-54-6 Molecular Formula: C23H23N3O5 Molecular Weight (g/mol): 421.45 MDL Number: MFCD28989044 InChI Key: UCFGDBYHRUNTLO-QHCPKHFHSA-N Synonym: topotecan hydrochloride,topotecan hcl,hycamptamine hydrochloride,topotecan monohydrochloride,unii-956s425zcy,topotecan hydrochloride usan,nogitecan hydrochloride,dsstox_cid_25952,dsstox_rid_81248 PubChem CID: 60699 IUPAC Name: (19S)-8-[(dimethylamino)methyl]-19-ethyl-7,19-dihydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione SMILES: CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=C(CN(C)C)C(O)=CC=C4N=C13)C2=O

PubChem CID 60699
CAS 119413-54-6
Molecular Weight (g/mol) 421.45
MDL Number MFCD28989044
SMILES CC[C@@]1(O)C(=O)OCC2=C1C=C1N(CC3=CC4=C(CN(C)C)C(O)=CC=C4N=C13)C2=O
Synonym topotecan hydrochloride,topotecan hcl,hycamptamine hydrochloride,topotecan monohydrochloride,unii-956s425zcy,topotecan hydrochloride usan,nogitecan hydrochloride,dsstox_cid_25952,dsstox_rid_81248
IUPAC Name (19S)-8-[(dimethylamino)methyl]-19-ethyl-7,19-dihydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2,4,6,8,10,15(20)-heptaene-14,18-dione
InChI Key UCFGDBYHRUNTLO-QHCPKHFHSA-N
Molecular Formula C23H23N3O5
6

Amlexanox, Tocris Bioscience™

CAS: 68302-57-8 Molecular Formula: C16H14N2O4 Molecular Weight (g/mol): 298.30 MDL Number: MFCD00864790 InChI Key: SGRYPYWGNKJSDL-UHFFFAOYSA-N Synonym: amlexanox,aphthasol,amoxanox,2-amino-7-isopropyl-5-oxo-5h-chromeno 2,3-b pyridine-3-carboxylic acid,amlenanox,solfa,amlexanoxo,amlexanoxum,amlexanoxum latin,amlexanoxo spanish PubChem CID: 2161 ChEBI: CHEBI:31205 IUPAC Name: 2-amino-5-oxo-7-(propan-2-yl)-5H-chromeno[2,3-b]pyridine-3-carboxylic acid SMILES: CC(C)C1=CC=C2OC3=NC(N)=C(C=C3C(=O)C2=C1)C(O)=O

PubChem CID 2161
CAS 68302-57-8
Molecular Weight (g/mol) 298.30
ChEBI CHEBI:31205
MDL Number MFCD00864790
SMILES CC(C)C1=CC=C2OC3=NC(N)=C(C=C3C(=O)C2=C1)C(O)=O
Synonym amlexanox,aphthasol,amoxanox,2-amino-7-isopropyl-5-oxo-5h-chromeno 2,3-b pyridine-3-carboxylic acid,amlenanox,solfa,amlexanoxo,amlexanoxum,amlexanoxum latin,amlexanoxo spanish
IUPAC Name 2-amino-5-oxo-7-(propan-2-yl)-5H-chromeno[2,3-b]pyridine-3-carboxylic acid
InChI Key SGRYPYWGNKJSDL-UHFFFAOYSA-N
Molecular Formula C16H14N2O4
7

SN 38, Tocris Bioscience™

CAS: 86639-52-3 Molecular Formula: C22H20N2O5 Molecular Weight (g/mol): 392.411 InChI Key: FJHBVJOVLFPMQE-QFIPXVFZSA-N Synonym: 7-ethyl-10-hydroxycamptothecin,sn 38 lactone,7-ethyl-10-hydroxy-camptothecin,10-hydroxy-7-ethylcamptothecin,7-ethyl-10-hydroxycamptothecine,le-sn38,7-ethyl-10-hydroxy-20 s-camptothecin,captothecin, 7-ethyl-10-hydroxy,s-4,11-diethyl-4,9-dihydroxy-1h-pyrano 3',4':6,7 indolizino 1,2-b quinoline-3,14 4h,12h-dione,7-ethyl-10-hydroxy camptothecin PubChem CID: 104842 ChEBI: CHEBI:8988 SMILES: CCC1=C2C=C(C=CC2=NC3=C1CN4C3=CC5=C(C4=O)COC(=O)C5(CC)O)O

PubChem CID 104842
CAS 86639-52-3
Molecular Weight (g/mol) 392.411
ChEBI CHEBI:8988
SMILES CCC1=C2C=C(C=CC2=NC3=C1CN4C3=CC5=C(C4=O)COC(=O)C5(CC)O)O
Synonym 7-ethyl-10-hydroxycamptothecin,sn 38 lactone,7-ethyl-10-hydroxy-camptothecin,10-hydroxy-7-ethylcamptothecin,7-ethyl-10-hydroxycamptothecine,le-sn38,7-ethyl-10-hydroxy-20 s-camptothecin,captothecin, 7-ethyl-10-hydroxy,s-4,11-diethyl-4,9-dihydroxy-1h-pyrano 3',4':6,7 indolizino 1,2-b quinoline-3,14 4h,12h-dione,7-ethyl-10-hydroxy camptothecin
InChI Key FJHBVJOVLFPMQE-QFIPXVFZSA-N
Molecular Formula C22H20N2O5
8

XAV 939, Tocris Bioscience™

CAS: 284028-89-3 Molecular Formula: C14H11F3N2OS Molecular Weight (g/mol): 312.31 InChI Key: KLGQSVMIPOVQAX-UHFFFAOYSA-N Synonym: 3,5,7,8-tetrahydro-2-4-trifluoromethyl phenyl-4h-thiopyrano 4,3-d pyrimidin-4-one,2-4-trifluoromethyl phenyl-7,8-dihydro-5h-thiopyrano 4,3-d pyrimidin-4-ol,2-4-trifluoromethyl phenyl-7,8-dihydro-5h-thiino 4,3-d pyrimidin-4-ol,2-4-trifluoromethyl phenyl-5h,7h,8h-thiopyrano 4,3-d pyrimidin-4-ol,2-4-trifluoromethyl phenyl-1,5,7,8-tetrahydrothiopyrano 4,3-d pyrimidin-4-one,2-4-trifluoromethyl phenyl-1,5,7,8-tetrahydro-4h-thiopyrano 4,3-d pyrimidin-4-one,2-4-trifluoromethyl phenyl-1h,5h,7h,8h-thiopyrano 4,3-d pyrimidin-4-one,2-4-trifluoromethyl phenyl-3h,5h,7h,8h-thiopyrano 4,3-d pyrimidin-4-one PubChem CID: 2726824 ChEBI: CHEBI:62878 IUPAC Name: 2-[4-(trifluoromethyl)phenyl]-1,5,7,8-tetrahydrothiopyrano[4,3-d]pyrimidin-4-one SMILES: C1CSCC2=C1NC(=NC2=O)C3=CC=C(C=C3)C(F)(F)F

PubChem CID 2726824
CAS 284028-89-3
Molecular Weight (g/mol) 312.31
ChEBI CHEBI:62878
SMILES C1CSCC2=C1NC(=NC2=O)C3=CC=C(C=C3)C(F)(F)F
Synonym 3,5,7,8-tetrahydro-2-4-trifluoromethyl phenyl-4h-thiopyrano 4,3-d pyrimidin-4-one,2-4-trifluoromethyl phenyl-7,8-dihydro-5h-thiopyrano 4,3-d pyrimidin-4-ol,2-4-trifluoromethyl phenyl-7,8-dihydro-5h-thiino 4,3-d pyrimidin-4-ol,2-4-trifluoromethyl phenyl-5h,7h,8h-thiopyrano 4,3-d pyrimidin-4-ol,2-4-trifluoromethyl phenyl-1,5,7,8-tetrahydrothiopyrano 4,3-d pyrimidin-4-one,2-4-trifluoromethyl phenyl-1,5,7,8-tetrahydro-4h-thiopyrano 4,3-d pyrimidin-4-one,2-4-trifluoromethyl phenyl-1h,5h,7h,8h-thiopyrano 4,3-d pyrimidin-4-one,2-4-trifluoromethyl phenyl-3h,5h,7h,8h-thiopyrano 4,3-d pyrimidin-4-one
IUPAC Name 2-[4-(trifluoromethyl)phenyl]-1,5,7,8-tetrahydrothiopyrano[4,3-d]pyrimidin-4-one
InChI Key KLGQSVMIPOVQAX-UHFFFAOYSA-N
Molecular Formula C14H11F3N2OS
10

2,5-Dibromobenzotrifluoride, 98%, Thermo Scientific™

CAS: 7657-09-2 MDL Number: MFCD00013554 ChEBI: CHEBI:27656

CAS 7657-09-2
ChEBI CHEBI:27656
MDL Number MFCD00013554