记录说明
31-[6-[6-[6-(16-chloro-1,2-dihydroxy-hexadeca-3,13,15-trienyl)-4,5-dihydroxy-tetrahydropyran-2-yl]-1,5,6-trihydroxy-4-methylene-hexyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl]-16,21, 收自 NPASS。关联生物包括 Karlodinium veneficum。
C67H123ClO24
式量由分子式和标准同位素质量计算,1346.809283。
31-[6-[6-[6-(16-chloro-1,2-dihydroxy-hexadeca-3,13,15-trienyl)-4,5-dihydroxy-tetrahydropyran-2-yl]-1,5,6-trihydroxy-4-methylene-hexyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl]-16,21, 收自 NPASS。关联生物包括 Karlodinium veneficum。
学名照录来源库原文,不是重新做的分类鉴定。
SMILES
C=C(CCC(O)C1OC(CC(O)C(O)C(C)CCCC(O)C(O)C(O)C(C)CCC(O)C(O)C(C)CC(O)CCCC(O)CCCC(O)CCCC(O)CO)C(O)C(O)C1O)C(O)C(O)C1CC(O)C(O)C(C(O)C(O)C=CCCCCCCCCC=CC=CCl)O1
InChIKey
JHLGNPFRKOCHDQ-UHFFFAOYSA-N
CAS:这里用的两张来源表里没有。
IUPAC
31-[6-[6-[6-(16-chloro-1,2-dihydroxy-hexadeca-3,13,15-trienyl)-4,5-dihydroxy-tetrahydropyran-2-yl]-1,5,6-trihydroxy-4-methylene-hexyl]-3,4,5-trihydroxy-tetrahydropyran-2-yl]-16,21,28-trimethyl-hentriacontane-1,2,6,10,14,17,18,22,23,24,29,30-dodecol