기본 정보
- 표준 SMILES
COc1c2cc(cc1C1(O)CN(C)C3CC(OC)C=CC31)OCO2- InChIKey
WGNHCYRPNUGSKT-UHFFFAOYSA-N- 분자식
- C18H23NO5
- 평균 분자량
- 333.4 g/mol
- 단동위원소 질량
- 333.15762284
개요
Tazettadiol has been reported in Hippeastrum puniceum with data available.
이름 및 식별자
- 우선 이름
- Tazettadiol
- IUPAC
- 6-methoxy-3-(6-methoxy-2,4-dioxabicyclo[3.3.1]nona-1(8),5(9),6-trien-7-yl)-1-methyl-3a,6,7,7a-tetrahydro-2H-indol-3-ol
이름 및 동의어
Tazettadiol6-methoxy-3-(6-methoxy-2,4-dioxabicyclo[3.3.1]nona-1(8),5(9),6-trien-7-yl)-1-methyl-3a,6,7,7a-tetrahydro-2H-indol-3-ol(3S)-1-Methyl-3abeta-(6-(hydroxymethyl)-1,3-benzodioxole-5-yl)-6b-methoxy-2,3,3a,6,7,7abeta-hexahydro-1H-indole-3b-ol(3S)-1-Methyl-3abeta-(6-(hydroxymethyl)-1,3-benzodioxole-5-yl)-6I2-methoxy-2,3,3a,6,7,7abeta-hexahydro-1H-indole-3I2-ol(3S)-1-Methyl-3abeta-[6-(hydroxymethyl)-1,3-benzodioxole-5-yl]-6b-methoxy-2,3,3a,6,7,7abeta-hexahydro-1H-indole-3b-ol(3S)-1-Methyl-3abeta-[6-(hydroxymethyl)-1,3-benzodioxole-5-yl]-6I2-methoxy-2,3,3a,6,7,7abeta-hexahydro-1H-indole-3I2-ol6-methoxy-3-(6-methoxy-2,4-dioxabicyclo(3.3.1)nona-1(8),5(9),6-trien-7-yl)-1-methyl-3a,6,7,7a-tetrahydro-2H-indol-3-olRefChem:187617466-66-0WGNHCYRPNUGSKT-UHFFFAOYSA-N6-Methoxy-3-[6-methoxy-2,4-dioxabicyclo[3.3.1]nona-1(9),5,7-trien-7-yl]-1-methyl-2,3,3a,6,7,7a-hexahydro-1H-indol-3-ol #
물성
구조 계산 물성
- XLogP
- 1.3
- 극성 표면적
- 60.4 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 24
- 형식 전하
- 0
- 복잡도
- 500
관련 반응
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