Tereticornate A
HIT214316162
sdf文件结构编辑类似物检索
HIT ID: HIT214316162
Cas No: 149751-81-5
分子式: C40H54O6
分子量: 630.866
常用名: Tereticornate A
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (1S,4S,5R,8R,10S,13S,14R,17S,18R,19S,20R)-4,5,9,9,13,19,20-heptamethyl-23-oxo-24-oxahexacyclo[15.5.2.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracos-15-en-10-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
IUPAC: (1S,4S,5R,8R,10S,13S,14R,17S,18R,19S,20R)-4,5,9,9,13,19,20-heptamethyl-23-oxo-24-oxahexacyclo[15.5.2.0^{1,18}.0^{4,17}.0^{5,14}.0^{8,13}]tetracos-15-en-10-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
SMILES: [H][C@@]12[C@@H](C)[C@H](C)CC[C@]11CC[C@]3(C)[C@]2(OC1=O)C=C[C@]1([H])[C@@]2(C)CC[C@H](OC(=O)\C=C\c4ccc(O)c(OC)c4)C(C)(C)[C@]2([H])CC[C@@]31C |c:20|
SMILES: [H][C@@]12[C@@H](C)[C@H](C)CC[C@]11CC[C@]3(C)[C@]2(OC1=O)C=C[C@]1([H])[C@@]2(C)CC[C@H](OC(=O)\C=C\c4ccc(O)c(OC)c4)C(C)(C)[C@]2([H])CC[C@@]31C |c:20|
InChI key: IOGXUTZMCFOAOS-SALWDLGTSA-N
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