Name: Pterocarpadiol A
Rating: 5 (10 reviews)

有库存

sdf 文件

结构编辑

类似物检索

HIT ID:HIT213885148
Cas No:2055882-21-6
常用名:Pterocarpadiol A
IUPAC:(1S,12R,13S)-1,13-dihydroxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0^{2,10}.0^{4,8}.0^{13,18}]icosa-2,4(8),9,14,17-pentaen-16-one
IUPAC:(1S,12R,13S)-1,13-dihydroxy-5,7,11,19-tetraoxapentacyclo[10.8.0.0^{2,10}.0^{4,8}.0^{13,18}]icosa-2,4(8),9,14,17-pentaen-16-one
InChI key:GLFFSZJIPRAXLU-ARFHVFGLSA-N

分子式:C16H12O7
分子量:316.265
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:O[C@@]12COC3=CC(=O)C=C[C@]3(O)[C@@H]1Oc1cc3OCOc3cc21 |c:8,t:4|
SMILES:O[C@@]12COC3=CC(=O)C=C[C@]3(O)[C@@H]1Oc1cc3OCOc3cc21 |c:8,t:4|

Pterocarpadiol A is a kind of very rare 6a,11b-dihydroxypterocarpan, and its presence as a marker may be helpful in chemotaxonomical classification.

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