Vitas-M small molecule compound
2,3,23-trihydroxyurs-12-en-28-oic acid
Catalog ID
STK801367
SMILES OCC1(C)C(O)C(O)CC2(C1CCC1(C2CC=C2C1(C)CCC1(C2C(C)C(CC1)C)C(=O)O)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C30H48O5 MW 488.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H48O5/c1-17-9-12-30(25(34)35)14-13-28(5)19(23(30)18(17)2)7-8-22-26(3)15-20(32)24(33)27(4,16-31)21(26)10-11-29(22,28)6/h7,17-18,20-24,31-33H,8-16H2,1-6H3,(H,34,35)InChIKey
JXSVIVRDWWRQRT-UHFFFAOYSA-NSynonyms
856834-11-2(1S2R4aS6aS6bR8aR9R10R11R12aR12bR14bS)1011dihydroxy9(hydroxymethyl)126a6b912ahexamethyl12344a566a6b788a910111212a12b1314bicosahydropicene4acarboxylicacid
1011dihydroxy9(hydroxymethyl)126a6b912ahexamethyl234566a788a1011121314btetradecahydro1Hpicene4acarboxylicacid
2323trihydroxyurs12en28oicacid
856834112
CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)CO)O)O)C)C)C2C1C)C)C(=O)O
ESCULENTICACID(DIPLAZIUM)
InChI=1SC30H48O5c11791230(25(34)35)141328(5)19(23(30)18(17)2)782226(3)1520(32)24(33)27(41631)21(26)101129(2228)6h7171820243133H816H216H3(H3435)
OC(C@)1(C)(C@@H)(O)(C@H)(O)C(C@)2((C@H)1CC(C@@)1((C@@H)2CC=C2(C@@)1(C)CC(C@@)1((C@H)2(C@@H)(C)(C@@H)(CC1)C)C(=O)O)C)C
ZINC000242543350
ZINC000242543353
Check stock
See real-time availability and sample size for STK801367 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.