기본 정보
- CAS
66556-74-9- 표준 SMILES
C#CCN1CCC2=C(C1)c1c(OC(=O)CCCN3CCCCC3)cc(C(C)C(C)CCCCC)cc1OC2(C)C- InChIKey
MCVPMHDADNVRKF-UHFFFAOYSA-N- 분자식
- C35H52N2O3
- 평균 분자량
- 548.8 g/mol
- 단동위원소 질량
- 548.39779352
개요
has significant intraocular pressure lowering effect; tetrahydropyridobenzopyran derived from cannabinoid; RN given refers to parent cpd; structure
이름 및 식별자
- 우선 이름
- 8-(1,2-Dimethylheptyl)-1,3,4,5-tetrahydro-5,5-dimethyl-2-(2-propyn-1-yl)-2H-(1)benzopyrano(4,3-c)pyridin-10-yl 1-piperidinebutanoate
- IUPAC
- [5,5-dimethyl-8-(3-methyloctan-2-yl)-2-prop-2-ynyl-3,4-dihydro-1H-chromeno[4,3-c]pyridin-10-yl] 4-piperidin-1-ylbutanoate
- 현지명
- 나비탄
- 영어명
- Nabitan
- 분자식
- C35H52N2O3
- 분자량
- 548.8
이름 및 동의어
NABITANBenzopyranoperidineNabutan66556-74-9JO7BOR6B3ODTXSID40867230RefChem:914468DTXCID208154318-(1,2-Dimethylheptyl)-1,3,4,5-tetrahydro-5,5-dimethyl-2-(2-propyn-1-yl)-2H-(1)benzopyrano(4,3-c)pyridin-10-yl 1-piperidinebutanoateNabitan [INN]NabitanumNabitanum [INN-Latin]
이름 더 보기
나비탄( -)-8-(1,2-Dimethylheptyl)-2,3,4,5-tetrahydro-5,5-dimethyl-2-(2-propinyl)-1H-(1)benzopyrano(4,3-C)pyridin-10-yl 4-piperidinobutyrat( -)-8-(1,2-Dimethylheptyl)-1,3,4,5-tetrahydro-5,5-dimethyl-2-(2-propynyl)-2H-(1)benzopyrano(4,3-C)pyridin-10-yl 1-piperidinebutyrate1-Piperidinebutanoic acid, 8-(1,2-dimethylheptyl)-1,3,4,5-tetrahydro-5,5-dimethyl-2-(2-propynyl)-2H-(1)benzopyrano(4,3-C)pyridin-10-yl ester1-Piperidinebutanoic acid, 8-(1,2-dimethylheptyl)-1,3,4,5-tetrahydro-5,5-dimethyl-2-(2-propyn-1-yl)-2H-[1]benzopyrano[4,3-c]pyridin-10-yl ester
UNII-JO7BOR6B3O[5,5-dimethyl-8-(3-methyloctan-2-yl)-2-prop-2-ynyl-3,4-dihydro-1H-chromeno[4,3-c]pyridin-10-yl] 4-piperidin-1-ylbutanoateSCHEMBL489154CHEMBL2110593SCHEMBL31402797(+-)-8-(1,2-Dimethylheptyl)-1,3,4,5-tetrahydro-5,5-dimethyl-2-(2-propynyl)-2H-(1)benzopyrano(4,3-c)pyridin-10-yl 1-piperidinebutyrate(+-)-8-(1,2-Dimethylheptyl)-2,3,4,5-tetrahydro-5,5-dimethyl-2-(2-propinyl)-1H-(1)benzopyrano(4,3-c)pyridin-10-yl 4-piperidinobutyratQ1962034
물성
구조 계산 물성
- XLogP
- 6.9
- 극성 표면적
- 42 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 40
- 형식 전하
- 0
- 복잡도
- 911
화학 및 산업
응용 분야
용도Analgesic.
공급사1 곳
Lanospharma Laboratories Co.,Ltd13440048448 · [email protected]
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