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Methyl Dihydrobetulonate

CAS
20066-05-1
Catalog Number
ACM20066051
Category
Steroidal Compounds

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What is the PubChem CID for methyl dihydrobetulonate?

PubChem CID 44421394

What is the molecular formula of methyl dihydrobetulonate?

The molecular formula is C31H50O3.

What is the molecular weight of methyl dihydrobetulonate?

The molecular weight is 470.7 g/mol.

What is the IUPAC name of methyl dihydrobetulonate?

The IUPAC name is methyl (1S,3aS,5aR,5bR,7aR,11aR,11bR,13aR,13bR)-5a,5b,8,8,11a-pentamethyl-9-oxo-1-propan-2-yl-2,3,4,5,6,7,7a,10,11,11b,12,13,13a,13b-tetradecahydro-1H-cyclopenta[a]chrysene-3a-carboxylate.

What is the InChI key of methyl dihydrobetulonate?

The InChI key is DFCFXNDZRVOAHX-DSBZJMBESA-N.

What is the canonical SMILES of methyl dihydrobetulonate?

The canonical SMILES is CC(C)C1CCC2(C1C3CCC4C5(CCC(=O)C(C5CCC4(C3(CC2)C)C)(C)C)C)C(=O)OC.

What is the ChEMBL ID of methyl dihydrobetulonate?

The ChEMBL ID is CHEMBL387150.

What is the XLogP3-AA value of methyl dihydrobetulonate?

The XLogP3-AA value is 8.3.

How many hydrogen bond donor counts does methyl dihydrobetulonate have?

It has 0 hydrogen bond donor counts.

How many heavy atoms are there in methyl dihydrobetulonate?

There are 34 heavy atoms in methyl dihydrobetulonate.

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