AG0036H5

83-88-5 | 1-Deoxy-1-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10(2H)-yl)-D-ribitol

AG0036H5

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CAS Number	83-88-5
Catalog Number	AG0036H5(AGN-PC-0UPRCQ)
Chemical Name	1-Deoxy-1-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10(2H)-yl)-D-ribitol
EC Number	201-507-1
IUPAC Name	7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione
InChI	InChI=1S/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/t11-,12+,14-/m0/s1
InChI Key	AUNGANRZJHBGPY-SCRDCRAPSA-N
MDL Number	MFCD00005022
Molecular Formula	C17H20N4O6
Molecular Weight	376.3639
RTECS Number	VJ1400000
SMILES	CC=1C(=CC2=C(N=C3C(NC(N=C3N2C[C@H](O)[C@H](O)[C@H](O)CO)=O)=O)C1)C
UNII	TLM2976OFR
Synonyms	Riboflavin, Vitamin B 2, Vitamin B2, Vitamin G, riboflavin, vitamin B2, Lactoflavin, Riboflavine, Vitamin G, 83-88-5, Lactoflavine, (-)-riboflavin, Beflavin, Beflavine, Flavaxin, Riboflavina, Ribocrisina, Riboflavinum, Vitaflavine, Flaxain, Lactobene, Ribipca, Riboderm, Ribosyn, Ribotone, Ribovel, Flavin BB, Vitasan B2, Dermadram, Fiboflavin, Hyflavin, HYRE, Aqua-Flave, Vitamin Bi, 7,8-Dimethyl-10-ribitylisoalloxazine, E101, Russupteridine Yellow III, 6,7-Dimethyl-9-D-ribitylisoalloxazine, Riboflavinequinone, Riboflavine [INN-French], Riboflavinum [INN-Latin], Riboflavina [INN-Spanish], HSDB 817, UNII-TLM2976OFR, CCRIS 1904, CHEBI:17015, 7,8-Dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)isoalloxazine, C17H20N4O6, EINECS 201-507-1, MFCD00005022, NSC 33298, Riboflavin (Vitamin B2), TLM2976OFR, 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]benzo[g]pteridine-2,4-dione, AI3-14697, Isoalloxazine, 7,8-dimethyl-10-D-ribityl-, AUNGANRZJHBGPY-SCRDCRAPSA-N, D-Ribitol, 1-deoxy-1-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo(g)pteridin-10(2H)-yl)-, DSSTox_CID_1777, Isoalloxazine, 7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)-, 1-Deoxy-1-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10(2H)-yl)-D-ribitol, 1-deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol, DSSTox_RID_76321, DSSTox_GSID_21777, Ovoflavin, 1-Deoxy-1-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)pentitol, 7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4(3H,10H)-dione, 7,8-dimethyl-10-((2S,3S,4R)-2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4(3H,10H)-dione, Riboflavin(B2);7,8-Dimethyl-10-((2S,3S,4R)-2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4(3H,10H)-dione, Riboflavin (Vit B2), Benzo(g)pteridine-2,4(3H,10H)-dione, 7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)-, Riboflavin [USP:INN:BAN], Riboflavin [USAN:INN:JAN], 1kyv, 2ccb, 2vxa, ()-Riboflavin, San Yellow B, CAS-83-88-5, NCGC00017291-05, Bisulase (TN), 13123-37-0, Food Yellow 15, Prestwick_442, Riboflavin-Vitamin-B2, Vitamin B2;E101, 2fl5, 2vx9, 4d1y, Prestwick3_000634, Epitope ID:161730, AC1LAR57, SCHEMBL7706, CHEMBL1534, BSPBio_000628, MLS001066391, BPBio1_000692, GTPL6578, Riboflavin (JP17/USP/INN), RIBOFLAVINE; VITAMIN B2, DTXSID8021777, BIR0613, ZX-AFC000568, (-)-Riboflavin, 97-103%, HMS2096P10, Benzo[g]pteridine riboflavin deriv., HY-B0456, ZINC2036848, Tox21_110813, Tox21_111714, Tox21_201633, Tox21_302980, 6,7-Dimethyl-9-ribitylisoalloxazine, BDBM50362895, s2540, Riboflavin (B2), analytical standard, Tox21_111714_1, CS-2567, DB00140, LS-2192, RL05171, NCGC00091288-01, NCGC00091288-02, NCGC00091288-03, NCGC00091288-05, NCGC00179498-01, NCGC00256408-01, NCGC00259182-01, AS-15936, R437, SMR000112236, AB0008077, AB2000637, ST2413784, R0020, (-)-Riboflavin, tested according to Ph.Eur., C00255, D00050, Y-9791, (-)-Riboflavin, meets USP testing specifications, A840676, (-)-Riboflavin, from Eremothecium ashbyii, >=98%, (-)-Riboflavin, acrylamide photopolymerization tested, Riboflavin, European Pharmacopoeia (EP) Reference Standard, Riboflavin, United States Pharmacopeia (USP) Reference Standard, 3,10-Dihydro-7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl, Riboflavin, Pharmaceutical Secondary Standard; Certified Reference Material, 5-deoxy-5-(7,8-dimethyl-2,4-dioxo-3,4-dihydrobenzo[g]pteridin-10(2H)-yl)-D-ribitol, 7,8-dimethyl-10-(D-ribo-2,3,4,5-tetrahydroxypentyl)-Benzo[g]pteridine-2,4(3H,10H)-dione, Riboflavin for peak identification, European Pharmacopoeia (EP) Reference Standard, (-)-Riboflavin (Vitamin B2) solution, 100 mug/mL (Methanol:0.1% Ammonium acetate in Water (1:1)), ampule of 1 mL, analytical standard, (-)-Riboflavin, 100 mug/mL (1% ammonium acetate in 50:50 methanol:water), certified reference material, ampule of 1 mL, (-)-Riboflavin, BioReagent, suitable for cell culture, suitable for insect cell culture, >=98%, (-)-Riboflavin-13C4,15N2 (Vitamin B2-13C4,15N2) solution, 100 mug/mL (1% ammonium acetate in 50:50 methanol:water), certified reference material, ampule of 1 mL, 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrahydroxypentyl]-2H,3H,4H,10H-benzo[g]pteridine-2,4-dione, 7,8-dimethyl-10-[(2S,3S,4R)-2,3,4,5-tetrakis(oxidanyl)pentyl]benzo[g]pteridine-2,4-dione, InChI=1/C17H20N4O6/c1-7-3-9-10(4-8(7)2)21(5-11(23)14(25)12(24)6-22)15-13(18-9)16(26)20-17(27)19-15/h3-4,11-12,14,22-25H,5-6H2,1-2H3,(H,20,26,27)/t11-,12+,14-/m0/s, Araboflavin, Lyxoflavine, Bisulase, Vitaped, Flavin, VibeX, Infuvite Pediatric, Cernevit-12, Lyxoflavine [MI], Vitamin B 2, Riboflavin tetrabutyrate, Riboflavin, 98% 25g, Vitamin B2 (Riboflavin), C.I. Food Yellow 15, Riboflavine (vitamin B2), D04QST, Riboflavin5'-SodiumPhosphate, UNII-STP460337X, CID493570, NSC-18343, C17-H20-N4-O6, Riboflavin, 98% - 100G 100g, ACN-052211, CS-O-02238, CS-O-31031, NCGC00159494-02, 7,8-dimethyl-10-ribityl-nu-isoalloxazine, C.I. 50900, E 101, D012256, Riboflavin 99% for biochemistry (Vitamin B2) 5gm, L-Arabinitol, 5-deoxy-5-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo(g)pteridin-10(2H)-yl)-, L-Arabinitol, 5-deoxy-5-(3,4-dihydro-7,8-dimethyl-2,4-dioxobenzo[g]pteridin-10(2H)-yl)-, RBF,

Complexity	680
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	376.138g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	5
Isotope Atom Count	0
Molecular Weight	376.369g/mol
Monoisotopic Mass	376.138g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	155A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-1.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code	\N

Certificate of Analysis

Lot Number