AG00I99A

518-17-2 | Indolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one,8,13,13b,14-tetrahydro-14-methyl-, (13bS)-

AG00I99A

SDS

COA

Price

$0.00

WARNING This product is not for human or veterinary use.

CAS Number	518-17-2
Catalog Number	AG00I99A(AGN-PC-0SBD0C)
Chemical Name	Indolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one,8,13,13b,14-tetrahydro-14-methyl-, (13bS)-
IUPAC Name	(1S)-21-methyl-3,13,21-triazapentacyclo[11.8.0.02,10.04,9.015,20]henicosa-2(10),4,6,8,15,17,19-heptaen-14-one
InChI	InChI=1S/C19H17N3O/c1-21-16-9-5-3-7-14(16)19(23)22-11-10-13-12-6-2-4-8-15(12)20-17(13)18(21)22/h2-9,18,20H,10-11H2,1H3/t18-/m0/s1
InChI Key	TXDUTHBFYKGSAH-SFHVURJKSA-N
MDL Number	MFCD06407824
Molecular Formula	C19H17N3O
Molecular Weight	303.3578
SMILES	O=C1C2=CC=CC=C2N(C)[C@](N1CC3)([H])C4=C3C5=CC=CC=C5N4
UNII	C01825BVNL
Synonyms	evodiamine, evodiamine, (S)-isomer, isoevodiamine, Evodiamine, 518-17-2, (+)-Evodiamine, UNII-C01825BVNL, Evodiamine, Evodia rutaecarpa, d-Evodiamine, C01825BVNL, CHEBI:4948, Evodiamine, 98%, Evodiamine, (+)-, Q-100579, C19H17N3O, (S)-14-methyl-8,13,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one, PubChem18244, Indolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-, (13bS)-, AC1L9C8E, MFCD06407824, Evodiamine,(S), (13bS)-14-methyl-8,13,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(7H)-one, Evodiamine(Isoevodiamine), Evodiamine(Isoevodiamine)/, KSC270Q0P, MLS006011787, SCHEMBL682158, CHEMBL463165, CTK1H0807, ZINC898159, BCP02282, HY-N0114, Indol(2',3':3,4)pyrido(2,1-b)quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-, (13bS)-, Indol(2',3':3,4)pyrido(2,1-b)quinazolin-5(7H)-one, 8,13,13b,14-tetrahydro-14-methyl-, (S)-, ABP000693, BBL033833, STK801981, AKOS005622478, CS-6161, MCULE-2788564607, CJ-04510, SC-16015, SMR001934404, FT-0651829, N1600, C09187, 518E172, Evodiamine, European Pharmacopoeia (EP) Reference Standard, (S)-14-methyl-7,8,13b,14-tetrahydroindolo[2',3':3,4]pyrido[2,1-b]quinazolin-5(13H)-one, Isoevodiamine, C19-H17-N3-O, CID442088, ACN-035654, CB10239, A10376, Evodiamine, 98%, from Evodia rutaecarpa (Juss.) Benth. - 100MG 100mg, 8,13,13b,14-Tetrahydro-14-methylindolo[2'3'-3,4]pyrido[2,1-b]quinazolin-5-[7H]-one,

Complexity	495
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	303.137g/mol
Formal Charge	0
Heavy Atom Count	23
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	303.365g/mol
Monoisotopic Mass	303.137g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	39.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	\N
Hazard statements	H302
Packing Group	\N
Precautionary statements	P280-P305+P351+P338
Signal Words	warning
UN Code	\N

Certificate of Analysis

Lot Number