(1R,6S)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid

HCID 440977
부분 구조 검색유사 구조 찾기

기본 정보

표준 SMILES
O=C(O)[C@@]1(O)C=CC=C[C@@H]1O
InChIKey
PUCYIVFXTPWJDD-CAHLUQPWSA-N
분자식
C7H8O4
평균 분자량
156.14 g/mol

개요

(1R,6S)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid is a cis-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid. It is a conjugate acid of a (1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylate. It is an enantiomer of a (1S,6R)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid.

이름 및 식별자

우선 이름
(1R,6S)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acid
IUPAC
(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid

이름 및 동의어

(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acid(1R,6S)-1,6-dihydroxycyclohexa-2,4-dienecarboxylic acidcis-1,6-Dihydroxy-2,4-cyclohexadiene-1-carboxylic acidCHEBI:37888(1R,2S)-1,2-dihydroxycyclohexa-3,5-diene-1-carboxylic acidRefChem:68372cis-1,2-dihydroxycyclohexa-3,5-diene-1-carboxylaterel-(1R,6S)-1,6-dihydroxycyclohexa-2,4-diene-1-carboxylic acidPUCYIVFXTPWJDD-CAHLUQPWSA-NC06321Q271173042,4-Cyclohexadiene-1-carboxylic acid, 1,6-dihydroxy-, (1R,6S)-rel-

데이터베이스 식별자

PubChem CID
440977
ChEBI
CHEBI:37888
Nikkaji
J1.936.395C

물성

구조 계산 물성

XLogP
0.1
극성 표면적
77.8 Ų
수소 결합 공여자 수
3
수소 결합 수용자 수
4
회전 가능 결합 수
1
무거운 원자 수
11

관련 반응

3건
반응 기록 만들기

연결된 노트

불러오는 중…