기본 정보
- CAS
96989-32-1- 표준 SMILES
CCCCC/C=C/C=C/C(=O)OCC(O)C1OC(OC2C(CO)OC(c3c(O)cc(O)cc3CO)C(O)C2OC(=O)/C=C/C=C/CC(O)/C=C/C=C/C(C)C)C(O)C1O- InChIKey
MDYKQSGFAWSGPE-DARJXQBKSA-N- 분자식
- C43H60O16
- 평균 분자량
- 832.9 g/mol
- 단동위원소 질량
- 832.38813582
개요
D-Glucitol, 1,5-anhydro-1-C-(2,4-dihydroxy-6-(hydroxymethyl)phenyl)-4-O-(6-O-(1-oxo-2,4-decadienyl)-beta-D-galactopyranosyl)-, 3-(7-hydroxy-2,4,8,10-tetradecatetraenoate) has been reported in Monochaetia dimorphospora with data available.
이름 및 식별자
- 우선 이름
- D-Glucitol, 1,5-anhydro-1-C-(2,4-dihydroxy-6-(hydroxymethyl)phenyl)-4-O-(6-O-(1-oxo-2,4-decadienyl)-beta-D-galactopyranosyl)-, 3-(7-hydroxy-2,4,8,10-tetradecatetraenoate)
- IUPAC
- [5-[5-[2-[(2E,4E)-deca-2,4-dienoyl]oxy-1-hydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy-2-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-3-hydroxy-6-(hydroxymethyl)oxan-4-yl] (2E,4E,8E,10E)-7-hydroxy-12-methyltrideca-2,4,8,10-tetraenoate
- 현지명
- 채티아칸딘
- 영어명
- Chaetiacandin
- 분자식
- C43H60O16
- 분자량
- 832.931
이름 및 동의어
D-Glucitol, 1,5-anhydro-1-C-(2,4-dihydroxy-6-(hydroxymethyl)phenyl)-4-O-(6-O-(1-oxo-2,4-decadienyl)-beta-D-galactopyranosyl)-, 3-(7-hydroxy-2,4,8,10-tetradecatetraenoate)RefChem:1082879(5-(5-(2-((2E,4E)-deca-2,4-dienoyl)oxy-1-hydroxyethyl)-3,4-dihydroxyoxolan-2-yl)oxy-2-(2,4-dihydroxy-6-(hydroxymethyl)phenyl)-3-hydroxy-6-(hydroxymethyl)oxan-4-yl) (2E,4E,8E,10E)-7-hydroxy-12-methyltrideca-2,4,8,10-tetraenoate채티아칸딘Chaetiacandin1,5-Anhydro-1-C-[2,4-dihydroxy-6-(hydroxymethyl)phenyl]-4-O-[6-O-(1-oxo-2,4-decadienyl)-β-D-galactopyranosyl]-D-glucitol 3-(7-hydroxy-2,4,8,10-tetradecatetraenoate)
데이터베이스 식별자
- CAS
96989-32-1- PubChem CID
- 6438679
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 262 Ų
- 수소 결합 공여자 수
- 9
- 수소 결합 수용자 수
- 16
- 회전 가능 결합 수
- 24
- 무거운 원자 수
- 59
- 형식 전하
- 0
- 복잡도
- 1,430
화학 및 산업
공급사1 곳
浙江珲达生物科技有限公司0571-89903022 18679456698 · [email protected]
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