기본 정보
- CAS
72984-32-8- 표준 SMILES
C=CC1=C(C)C2=NC1=CC1=NC(=Cc3[n-]c4c(c3C)=C([O-])C(C(=O)[O-])C=4C3=NC(=C2)C(C)C3CCC(=O)[O-])C(CC)=C1C.[Cu+2].[K+].[K+]- InChIKey
OWPZVZBRJWPUFS-UHFFFAOYSA-J- 분자식
- C34H30CuK2N4O5
- 평균 분자량
- 716.4 g/mol
- 단동위원소 질량
- 715.07863
이름 및 식별자
- 우선 이름
- Cuprate(2-), ((3S,4S,21R)-21-carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoato(4-)-kappaN23,kappaN24,kappaN25,kappaN26)-, dipotassium, (SP-4-2)-
- IUPAC
- copper;dipotassium;22-(2-carboxylatoethyl)-16-ethenyl-11-ethyl-12,17,21,26-tetramethyl-4-oxido-23,24,25-triaza-7-azanidahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1(23),2(6),4,8(26),9,11,13(25),14,16,18(24),19-undecaene-3-carboxylate
이름 및 동의어
72984-32-8EINECS 277-165-2Cuprate(2-), ((3S,4S,21R)-21-carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoato(4-)-kappaN23,kappaN24,kappaN25,kappaN26)-, dipotassium, (SP-4-2)-DTXSID40993745OWPZVZBRJWPUFS-UHFFFAOYSA-JCuprate(2-), ((3S,4S,21R)-21-carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoato(4-)-kappaN23,kappaN24,kappaN25,kappaN26)-, potassium (1:2), (SP-4-2)-Cuprate(2-), [(3S,4S,21R)-21-carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoato(4-)-.kappa.N23,.kappa.N24,.kappa.N25,.kappa.N26]-, dipotassium, (SP-4-2)-Copper(2+) potassium 3-(2-carboxylatoethyl)-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-23,25-didehydrophorbine-24,25-diide-21-carboxylate (1/2/1)Dipotassium (3S-(3alpha,4beta,21beta))-(21-carboxy-14-ethyl-4,8,13,18-tetramethyl-20-oxo-9-vinylphorbine-3-propionato(4-)-N23,N24,N25,N26)cuprate(2-)
데이터베이스 식별자
- CAS
72984-32-8- PubChem CID
- 175352
- DTXSID
물성
구조 계산 물성
- 극성 표면적
- 141 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 46
- 형식 전하
- 0
- 복잡도
- 1,790
화학 및 산업
용도 및 제조
General Manufacturing InformationCuprate(2-), [(3S,4S,21R)-21-carboxy-9-ethenyl-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-phorbinepropanoato(4-)-.kappa.N23,.kappa.N24,.kappa.N25,.kappa.N26]-, potassium (1:2), (SP-4-2)-: INACTIVE
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