Quinovic acid
(1S,2R,4aS,6aR,6aR,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6b,9,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a,6a-dicarboxylic acid
Also Known As: Quinovic acid|Quinovaic acid|Chinovic acid|Chinova acid|Quivic acid|Quinovicacid|QUINOVIC ACID [MI]|Chinovic acid; Quinovaic acid|HY-N1524|NP6276|3-beta-Hydroxyurs-12-ene-27,28-dioic acid|FS-9901|(1S,2R,4aS,6aR,6aR,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6b,9,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a,6a-dicarboxylic acid|3-Hydroxyurs-12-ene-27,28-dioic acid|4CN-1499|ACRYLONITRILE, 2,3,3-TRIPHENYL-|(3-beta)-3-Hydroxyurs-12-ene-27,28-dioic acid|3beta-hydroxyurs-12-en-27,28-dioic acid|(3beta)-3-hydroxyurs-12-ene-27,28-dioic acid|Urs-12-ene-27,28-dioic acid, 3-beta-hydroxy-|4-10-00-02197 (Beilstein Handbook Reference)|3BETA-HYDROXYURS-12-ENE-27,28-DIOIC ACID
| Molecular Formula | C30H46O5 |
|---|---|
| Molecular Weight | 486.33453 g/mol |
| LogP | 6.15 |
| Topological Polar Surface Area | 94.83 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 486.33453 |
| Heavy Atoms | 35 |
| Complexity | 967.8 |
Chemical Identifiers
| CAS Number | 465-74-7 |
|---|---|
| SMILES | C[C@@H]1CC[C@@]2(CC[C@@]3(C(=CC[C@H]4[C@]3(CC[C@@H]5[C@@]4(CC[C@@H](C5(C)C)O)C)C)[C@@H]2[C@H]1C)C(=O)O)C(=O)O |
Product Overview
Quinovic acid (CAS 465-74-7), with molecular formula C30H46O5 and molecular weight 486.33453 g/mol. IUPAC: (1S,2R,4aS,6aR,6aR,6bR,8aR,10S,12aR,14bS)-10-hydroxy-1,2,6b,9,9,12a-hexamethyl-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-4a,6a-dicarboxylic acid.
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