Account (3S,4aR,6aR,6bS,8S,8aR,9S,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-3,8,9-triol
- Catalog No. :
- ACJRLU111
- CAS No. :
- 1242085-06-8
- Molecular Formula :
- C30H50O3
- Molecular Weight :
- 458.73
IUPAC Name:(3S,4aR,6aR,6bS,8S,8aR,9S,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-3,8,9-triol
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Product Information
| Product Name | (3S,4aR,6aR,6bS,8S,8aR,9S,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-3,8,9-triol |
|---|---|
| IUPAC Name | (3S,4aR,6aR,6bS,8S,8aR,9S,11R,12S,12aS,14aR,14bR)-4,4,6a,6b,8a,11,12,14b-octamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-3,8,9-triol |
| Molecular Formula | C30H50O3 |
| Molecular Weight | 458.73 |
| SMILES | C[C@H]1[C@H](C)C[C@H](O)[C@@]2(C)[C@@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)C[C@@H]2O |
| InChI Key | BEGONBGYCMTFIR-RZAVEIDBSA-N |
| Synonym | 12-Ursene-3,16,22-triol;(3beta,16beta,22alpha)-Urs-12-ene-3,16,22-triol;Urs-12-ene-3β,16β,22α-triol;Urs-12-ene-3,16,22-triol, (3β,16β,22α)-;(3β16β22α)-Urs-12-ene-31622-triol/12-Ursene-31622-triol;16β;22α-triol;Urs-12-ene-3β |
| CAS No. | 1242085-06-8 |
Synthetic Route by SureRoute
2. ACJRLU111 Molecular Building Block Synthetic Route
(3S,4R,4aR,6aR,6bS,8S,8aS,9S,12aS,14aR,14bR)-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-3,8,9-triol
(3S,4R,4aR,6aR,6bS,8S,8aS,12aS,14aR,14bR)-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-3,8-diol
(3S,4aR,6aR,6bS,8R,8aS,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-3,8-diol