Name: Uvaol diacetate
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT217583827
Cas No:157000-65-2
常用名:Uvaol diacetate
IUPAC:1-acetyl-10-(acetyloxy)-7-[(5-{[5-({5-[(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl)oxy]-3a,3b-dihydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-11-yl 3-phenylprop-2-enoate
IUPAC:1-acetyl-10-(acetyloxy)-7-[(5-{[5-({5-[(3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl)oxy]-3a,3b-dihydroxy-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthren-11-yl 3-phenylprop-2-enoate
InChI key:PAKFPBVYDPPEIG-UHFFFAOYSA-N

分子式:C60H88O21
分子量:1145.343
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COC1CC(OC2CCC3(C)C4C(OC(C)=O)C(OC(=O)C=Cc5ccccc5)C5(C)C(CCC5(O)C4(O)CC=C3C2)C(C)=O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(O)C(OC)C3O)C(C)O2)C(C)O1
SMILES:COC1CC(OC2CCC3(C)C4C(OC(C)=O)C(OC(=O)C=Cc5ccccc5)C5(C)C(CCC5(O)C4(O)CC=C3C2)C(C)=O)OC(C)C1OC1CC(OC)C(OC2CC(OC)C(OC3OC(C)C(O)C(OC)C3O)C(C)O2)C(C)O1

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