Glycyrrhizic acid（CAS 1405-86-3）：分子式 C42H62O16、分子量 822.40 g/mol；类别 有机化学品。
| CAS号 | 1405-86-3 |
|---|---|
| 分子式 | C42H62O16 |
| 分子量 | 822.40 g/mol |
| 熔点 | 220 |
| LogP | 2.8 |
| 类别 | Organic Chemicals |
Glycyrrhizic acid 是一种以碳骨架为基础的有机化合物，登记 CAS 号为 1405-86-3，分子式 C42H62O16（分子量 822.40 g/mol），归属于有机化学品大类化工原料。
登记 CAS 号：1405-86-3
其分子式 C42H62O16 由 42 个碳、62 个氢、16 个氧 组成。
别名/同义词：Glycyrrhizic acid · Glycyrrhizin
所属分类：有机化学品
Glycyrrhizic acid 的 CAS 登记号为 1405-86-3。
分子式 C42H62O16，分子量 822.40 g/mol。
别名/同义词：Glycyrrhizic acid、Glycyrrhizin。
所属分类：Organic Chemicals。
Glycyrrhizic acid（CAS 1405-86-3）的独立参考数据，整理自公开化学数据库。
| CAS Registry Number | 1405-86-3 |
|---|---|
| PubChem CID | 14982 |
| Molecular formula | C42H62O16 |
| Molecular weight | 822.40 g/mol |
| IUPAC name | (2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,12aR,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid |
| InChIKey | LPLVUJXQOOQHMX-QWBHMCJMSA-N |
| UNII (FDA) | 6FO62043WK |
| ChEBI ID | CHEBI:15939 |
| ATC code (WHO) | A05BA08 |
| Molecular Weight | 822.9 |
|---|---|
| XLogP3 | 3.7 |
| Hydrogen Bond Donor Count | 8 |
| Hydrogen Bond Acceptor Count | 16 |
| Rotatable Bond Count | 7 |
| Exact Mass | 822.40378589 |
| Monoisotopic Mass | 822.40378589 |
| Topological Polar Surface Area | 267 |
| Heavy Atom Count | 58 |
| Melting Point | 220 |
|---|---|
| Melting Point | 220 °C decomposes |
| LogP | 2.8 |
| LogP | log Kow = 2.80 |
Glycyrrhizic acid; glycyrrhizin; 1405-86-3; Glycyron; Glycyrrhizinic acid; potenlini; beta-Glycyrrhizin; Glycyrrhetinic acid glycoside; Glizigen; 18beta-Glycyrrhizic acid; glycyrrhizate; 18-beta-Glycyrrhizic acid; Glycyrrizin; Rizinsan K2 A2 (free acid); HSDB 496; NSC-167409
| Regulatory & Food Contact | EU Flavoring substances Flavoring Agents NATURALLY_OCCURRING_TOXICANT: Food Contaminant TRS 928-JECFA 63/121 FAS 54-JECFA 63/561 CIR / INCI: Cosmetic ingredients (Glycyrrhizic Acid) -> CIR (Cosmetic Ingredient Review) |
|---|---|
| GHS notification summary | 100% (93 / 93) |
| GHS notification summary | 100% (93 / 93) |
|---|
This chemical does not meet GHS hazard criteria for 100% (93 of 93) of all reports.
Reported as not meeting GHS hazard criteria by 93 of 93 companies. For more detailed information, please visit ECHA C&L website.
Glycyrrhizic acid is identified by CAS 1405-86-3, molecular formula C42H62O16 and molecular weight 822.40 g/mol. UNII 6FO62043WK; ChEBI 15939; InChIKey LPLVUJXQOOQHMX-QWBHMCJMSA-N. Melting Point: 220; Melting Point: 220 °C decomposes; LogP: 2.8.
数据来源：PubChem / Wikidata；与随货 COA 不一致时以 COA 为准。
English page: Glycyrrhizic acid