11-hydroxy-9-(hydroxymethyl)-2-(methoxycarbonyl)-2,6a,6b,9,12a-pentamethyl-10-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid

group of stereoisomers with the chemical formula C₃₇H₅₈O₁₂

Wikidata entity: Q105192016

C₃₇H₅₈O₁₂ (P274)

Quantities

P2067mass694.3928272959998

P233 canonical SMILES String O=C(O)C12CCC(C(=O)OC)(C)CC2C3=CCC4C5(C)CC(O)C(OC6OC(CO)C(O)C(O)C6O)C(C)(CO)C5CCC4(C)C3(C)CC1 ???
P31 instance of ... Q59199015 (group of stereoisomers) group of stereoisomers
P2017 isomeric SMILES String COC(=O)C1(C)CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CC(O)C(O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(CO)C5CCC43C)C2C1 ???
P279 subclass of ... Q108544891 (oleanane triterpenoid) oleanane triterpenoid
External Ids
P234InChIInChI=1S/C37H58O12/c1-32(31(46)47-6)11-13-37(30(44)45)14-12-35(4)19(20(37)15-32)7-8-24-33(2)16-21(40)28(34(3,18-39)23(33)9-10-36(24,35)5)49-29-27(43)26(42)25(41)22(17-38)48-29/h7,20-29,38-43H,8-18H2,1-6H3,(H,44,45)/t20?,21?,22-,23?,24?,25-,26+,27-,28?,29+,32?,33?,34?,35?,36?,37?/m1/s1
P235InChIKeyOHDFISPWADYJIW-KVVJGARYSA-N
P662PubChem CID5317216
P11089UniChem compound ID62994636

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