Molecule record

(4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

C₃₀H₄₈O₃

456.71 g/mol

Loading structure

Molecular properties

Formula: C₃₀H₄₈O₃
Molar mass: 456.71 g·mol⁻¹
Exact mass: 456.3603 Da
: 7
PubChem CID: 10494

Functional groups

Alcohol

Alkane / alkyl carbon

Alkene

Carboxylic acid

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

(3-beta)-3-Hydroxyolean-12-en-28-oic acid
208-081-6
3-beta-Hydroxyolean-12-en-28-oic acid
3beta-Hydroxyolean-12-en-28-oic acid
508-02-1
6SMK8R7TGJ
Astrantiagenin C
CHEBI:37659

Show all 24 synonyms

Caryophyllin
DTXCID701474453
DTXSID50858790
Giganteumgenin C
MFCD00064914
NSC-114945
NSC114945
OLEANOLIC ACID
Olean-12-en-28-oic acid, 3-hydroxy-, (3beta)-
Oleanic acid
Oleanol
Oleanolic acid, analytical standard
RefChem:6084
Triterpenes, Oleanane
Virgaureagenin B
oleonolic acid

Structure identifiers

Canonical SMILES: CC1(C)CC[C@]2(C(=O)O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1
Isomeric SMILES: C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2CC=C4[C@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C(=O)O)C)C)(C)C)O
InChI: InChI=1S/C30H48O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h8,20-23,31H,9-18H2,1-7H3,(H,32,33)/t20-,21-,22+,23-,27-,28+,29+,30-/m0/s1
InChIKey: MIJYXULNPSFWEK-GTOFXWBISA-N
PubChem CID: 10494

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library

No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for (4aS,6aR,6aS,6bR,8aR,10S,12aR,14bS)-10-hydroxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)

Open source record