Bisabosqual A
HIT218847568
sdf文件结构编辑类似物检索
HIT ID: HIT218847568
Cas No: 180027-46-7
分子式: C23H28O5
分子量: 384.472
常用名: Bisabosqual A
氢键受体数 (HBA):
氢键供体数 (HBD):
LogP:
IUPAC: (7S,8R,11S,12R,13S)-11-hydroxy-7,11-dimethyl-7-(4-methylpent-3-en-1-yl)-6,15-dioxatetracyclo[10.2.1.0^{5,14}.0^{8,13}]pentadeca-1,3,5(14)-triene-2,3-dicarbaldehyde
IUPAC: (7S,8R,11S,12R,13S)-11-hydroxy-7,11-dimethyl-7-(4-methylpent-3-en-1-yl)-6,15-dioxatetracyclo[10.2.1.0^{5,14}.0^{8,13}]pentadeca-1,3,5(14)-triene-2,3-dicarbaldehyde
SMILES: [H][C@]12Oc3c4c(O[C@@](C)(CCC=C(C)C)[C@]([H])(CC[C@]1(C)O)[C@]24[H])cc(C=O)c3C=O
SMILES: [H][C@]12Oc3c4c(O[C@@](C)(CCC=C(C)C)[C@]([H])(CC[C@]1(C)O)[C@]24[H])cc(C=O)c3C=O
InChI key: JBVANMOFCVQYLP-MQRVUQIVSA-N
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