AG00398F

58-85-5 | 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-

AG00398F

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CAS Number	58-85-5
Catalog Number	AG00398F(AGN-PC-0SQPLX)
Chemical Name	1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-
EC Number	200-399-3
IUPAC Name	5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid
InChI	InChI=1S/C10H16N2O3S/c13-8(14)4-2-1-3-7-9-6(5-16-7)11-10(15)12-9/h6-7,9H,1-5H2,(H,13,14)(H2,11,12,15)/t6-,7-,9-/m0/s1
InChI Key	YBJHBAHKTGYVGT-ZKWXMUAHSA-N
MDL Number	MFCD00005541
Molecular Formula	C10H16N2O3S
Molecular Weight	244.3106
SMILES	O=C1N[C@H]2[C@@H](N1)CS[C@H]2CCCCC(=O)O
UNII	6SO6U10H04
Synonyms	Biodermatin, Biokur, Biotin, Biotin Gelfert, Biotin Hermes, Biotin ratiopharm, Biotin-ratiopharm, Biotine Roche, Deacura, Gabunat, Gelfert, Biotin, Hermes, Biotin, Medebiotin, medobiotin, Roche, Biotine, Rombellin, Vitamin H, biotin, d-biotin, vitamin H, 58-85-5, Vitamin B7, coenzyme R, Bios II, Factor S, Biodermatin, D(+)-Biotin, Medebiotin, Bioepiderm, Biotinum, Biotine, Meribin, Factor S (vitamin), (+)-Biotin, Injacom H, Lutavit H2, Biotina, beta-Biotin, Vitamin Bw, 3H-Biotin, NSC 63865, CCRIS 3932, HSDB 346, Biotine [INN-French], Biotinum [INN-Latin], Biotina [INN-Spanish], D-(+)-Biotin, 1swk, 1swn, 1swr, MFCD00005541, Rovimix H 2, D-Biotin Factor S, UNII-6SO6U10H04, cis-Hexahydro-2-oxo-1H-thieno(3,4)imidazole-4-valeric acid, cis-Tetrahydro-2-oxothieno(3,4-d)imidazoline-4-valeric acid, AI3-51198, EINECS 200-399-3, cis-(+)-Tetrahydro-2-oxothieno[3,4]imidazoline-4-valeric acid, (+)-cis-Hexahydro-2-oxo-1H-thieno[3,4]imidazole-4-valeric acid, 5-((3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid, 5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanoic acid, 1H-Thieno(3,4-d)imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS-(3aalpha,4beta,6aalpha))-, 5-[(3aS,4S,6aR)-2-oxo-hexahydro-1H-thieno[3,4-d]imidazolidin-4-yl]pentanoic acid, 2'-Keto-3,4-imidazolido-2-tetrahydrothiophene-N-valeric acid, CHEBI:15956, 6SO6U10H04, (3aS,4S,6aR)-Hexahydro-2-oxo-1H-thieno(3,4-d)imidazole-4-valeric acid, Hexahydro-2-oxo-1H-thieno(3,4-d)imidazole-4-pentanoic acid, (3aS-(3aalpha,4beta,6aalpha))-, Biotin (Vitamin B7), DSSTox_CID_2679, (3aS-(3aalpha,4b,6aalpha))-Hexahydro-2-oxo-1H-thieno(3,4-d)imidaz- ole-4-pentanoic acid, D(+)-Biotin, 98%, DSSTox_RID_76688, DSSTox_GSID_22679, medobiotin, Deacura, Gabunat, Rombellin, Biokur, Biotin Gelfert, Biotin Hermes, Biotine Roche, Biotin Forte, Gelfert, Biotin, Biotin ratiopharm, Biotin-ratiopharm, Hermes, Biotin, Roche, Biotine, (3aS,4S,6aR)-Hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-valeric acid, 1H-Thieno(3,4-d)imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS-(3aalpha,4b,6aalpha))-, 5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoic acid, Rovimix H2, BTN, SMR000112255, D(+)Biotin, 1H-thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-, Biotin [USP:INN:JAN], Biotin [USAN:INN:JAN], Biopeiderm, Hexahydro-2-oxo-1H-thieno(3,4-d)imidazole-4-pentanoic acid, d-biotine, delta-Biotin, Vitamin-h, 1avd, 1ndj, 1stp, 1swg, 1swp, 2avi, 4bcs, 4ggz, 4jnj, 1H-Thieno(3,4-d)imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)-, Bioepiderm (TN), biotin-vitamin-b7, CAS-58-85-5, Bios H, NCGC00094984-04, 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, [3as-(3aalpha,4beta,6aalpha)]-, 22377-59-9, 22879-79-4, Biotin111In, delta-(+)-Biotin, Biotin (8CI), delta-biotin factor s, 1df8, 1n9m, 2gh7, 3t2w, 4bj8, Prestwick0_000418, Prestwick1_000418, Prestwick2_000418, Prestwick3_000418, cid_253, BDBM12, bmse000227, CHEMBL857, Probes2_000006, AC1L57PN, SCHEMBL8763, BSPBio_000376, Biotin (JP17/USP/INN), hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoic acid, MLS001066402, MLS001074888, MLS001331736, MLS001333089, D-Biotin, analytical standard, SPBio_002315, BPBio1_000414, cid_171548, GTPL4787, 5-((4S)-2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid, DTXSID7022679, BIB0603, 1n43, 2f01, 5-((3AS,4S,6aR)-rel-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid, Biotin, >=99.0% (T), YBJHBAHKTGYVGT-ZKWXMUAHSA-N, ZX-AFC000477, HMS1569C18, HMS2096C18, HMS2271O06, HMS3713C18, BB_NC-01320, HY-B0511, Tox21_113050, Tox21_302161, BBL028095, Biotin, tested according to Ph.Eur., GV4685, s3130, STK801941, ZINC35024346, AKOS001287669, Tox21_113050_1, CCG-220418, CS-2719, DB00121, EBD2202242, LS-3171, MCULE-7440963355, RP28663, Biotin, meets USP testing specifications, Biotin, SAJ special grade, >=98.0%, NCGC00179580-01, NCGC00179580-02, NCGC00179580-04, NCGC00255377-01, 56846-45-8, AC-19998, AJ-45752, BP-20441, BR-44010, CC-35623, SC-18448, ST055761, AB0068872, AX8021635, Biotin, >=99% (TLC), lyophilized powder, Biotin, Vetec(TM) reagent grade, >=99%, TL8003761, AB00374191, B0463, FT-0601580, ST24024711, 58B855, C00120, D00029, M02926, S-1412, AB00374191-08, AB00374191_11, Biotin, plant cell culture tested, >=99% (TLC), C-14824, SR-01000765521, Biotin, certified reference material, TraceCERT(R), Q-200929, SR-01000765521-2, BRD-K89210380-001-03-8, BRD-K89210380-001-13-7, 6AE43AA3-BC3D-4C49-9DB9-5913A2401EB6, Biotin, European Pharmacopoeia (EP) Reference Standard, F2173-0855, Hexahydro-2-oxo-1H-thieno(3,4-d)imidazole-4-pentanoate, Z210803762, Biotin, United States Pharmacopeia (USP) Reference Standard, cis-(+)-Tetrahydro-2-oxothieno[3,4]imidazoline-4-valerate, (+)-cis-Hexahydro-2-oxo-1H-thieno[3,4]imidazole-4-valerate, 5-(2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoate, Daunorubicin hydrochloride, Antibiotic for Culture Media Use Only, (3aS,4S,6aR)-Hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-valerate, Biotin, Pharmaceutical Secondary Standard; Certified Reference Material, 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, (3aS,4S,6aR)- (9CI), 5-((3aR,6S,6aS)-2-Oxo-hexahydro-thieno[3,4-d]imidazol-6-yl)-pentanoic acid, 5-[(3aR,6S,6aS)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-6-yl]pentanoic acid, Biotin for system suitability, European Pharmacopoeia (EP) Reference Standard, hexahydro-2-oxo-[3aS-(3aa,4b,6aa)]-1H-Thieno[3,4-d]imidazole-4-pentanoate, hexahydro-2-oxo-[3aS-(3aa,4b,6aa)]-1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-[3as-(3alpha,4beta,6alpha)]-1H-Thieno[3,4-d]imidazole-4-pentanoate, hexahydro-2-oxo-[3as-(3alpha,4beta,6alpha)]-1H-Thieno[3,4-d]imidazole-4-pentanoic acid, BIOTIN, PharmaGrade, USP, meets FCC testing specifications, Manufactured under appropriate GMP controls for pharma or biopharmaceutical production., Biotin, powder, BioReagent, suitable for cell culture, suitable for insect cell culture, suitable for plant cell culture, >=99%, dl-Biotin, D-Biotin/Vitamin H, -(+)-Biotin, D0P8TJ, C10H16N2O3S, D-(+)-Biotin, 98% 1g, D-Biotin, 99% - 1G 1g, C10-H16-N2-O3-S, CID171548, ACN-052212, CB10961, CS-P-00358, A7051, A8010, D001710, D-Biotin 97% for biochemistry (Vitamin H) 100mg, 5-(2-Oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl)pentanoic acid, cis-tetrahydro-2-oxothieno[3,4-d]imidazoline-4-valeric acid, 5-(2-Oxo-hexahydro-thieno[3,4-d]imidazol-6-yl)-pentanoic acid, (3aS,4S,6aR)-Hexahydro-2-oxo-1H-thieno[3,4-d]imidazole-4-pentanoic acid, 8059-24-3, 10406-89-0, 1H-Thieno[3,4-d]imidazole-4-pentanoic acid, hexahydro-2-oxo-, [3as-(3a.alpha.,4.beta.,6a.alpha.)]-,

Complexity	298
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	3
Defined Bond Stereocenter Count	0
Exact Mass	244.088g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	3
Isotope Atom Count	0
Molecular Weight	244.309g/mol
Monoisotopic Mass	244.088g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	104A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number