기본 정보
- CAS
17029-36-6- 표준 SMILES
NC[C@H]1O[C@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)[C@H](O)[C@@H](OP(=O)(O)O)[C@@H]1O- InChIKey
BYGWYFIZOSNIDM-CAFUKSGOSA-N- 분자식
- C18H37N4O14P
- 평균 분자량
- 564.5 g/mol
- 단동위원소 질량
- 564.20438886
개요
Kanamycin A 3'-phosphate is an aminoglycoside phosphate. It is functionally related to a kanamycin A. It is a conjugate base of a kanamycin A 3'-phosphate(2+).
이름 및 식별자
- 우선 이름
- Kanamycin 3'-phosphate
- IUPAC
- [(2R,3R,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-3,5-dihydroxyoxan-4-yl] dihydrogen phosphate
이름 및 동의어
Kanamycin 3'-phosphatekanamycin A 3'-phosphate17029-36-6[(2R,3R,4S,5R,6R)-2-(aminomethyl)-6-[(1R,2R,3S,4R,6S)-4,6-diamino-3-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxy-3,5-dihydroxyoxan-4-yl] dihydrogen phosphate(1S,2R,3R,4S,6R)-4,6-diamino-3-(6-amino-6-deoxy-3-O-phosphono-alpha-D-glucopyranosyloxy)-2-hydroxycyclohexyl 3-amino-3-deoxy-alpha-D-glucopyranosideCHEBI:16823DTXSID20425877C03281Q27102097(1R,2R,3S,4R,6S)-4,6-Diamino-3-[(3-amino-3-deoxy-alpha-D-glucopyranosyl)oxy]-2-hydroxycyclohexyl 6-amino-6-deoxy-3-O-phosphono-alpha-D-glucopyranoside
데이터베이스 식별자
- CAS
17029-36-6- PubChem CID
- 6857355
- DTXSID
DTXSID20425877- ChEBI
CHEBI:16823- Nikkaji
- J2.741.520B
물성
구조 계산 물성
- XLogP
- -10.3
- 극성 표면적
- 329 Ų
- 수소 결합 공여자 수
- 12
- 수소 결합 수용자 수
- 18
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 798
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…