Name: Anemarrhenasaponin III
Rating: 5 (10 reviews)

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结构编辑

类似物检索

HIT ID:HIT214314477
Cas No:163047-23-2
常用名:Anemarrhenasaponin III
别名:知母皂苷III
IUPAC:2-{[4,5-dihydroxy-6-(hydroxymethyl)-2-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosan]-3'-oloxy}oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
IUPAC:2-{[4,5-dihydroxy-6-(hydroxymethyl)-2-{5,7',9',13'-tetramethyl-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosan]-3'-oloxy}oxan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
InChI key:FZEHHXRFTMAICH-UHFFFAOYSA-N

分子式:C39H64O14
分子量:756.927
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC1C2C(OC11CCC(C)CO1)C(O)C1C3CCC4CC(CCC4(C)C3CCC21C)OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O
SMILES:CC1C2C(OC11CCC(C)CO1)C(O)C1C3CCC4CC(CCC4(C)C3CCC21C)OC1OC(CO)C(O)C(O)C1OC1OC(CO)C(O)C(O)C1O

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