(Q105301254)

English

2-[2-[[8,14-Dihydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,5-dihydroxy-6-methyloxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

group of stereoisomers with the chemical formula C₄₂H₇₀O₁₄

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Statements

instance of

group of stereoisomers

0 references

subclass of

oleanane triterpenoid

1 reference

inferred from

oleanane triterpenoid

mass

798.9984 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₄₂H₇₀O₁₄

0 references

canonical SMILES

OCC1OC(OC2C(O)C(OC(C)C2O)OC3CCC4(C)C(CCC5(C)C4C(O)C=C6C7CC(C)(C)CCC7(CO)C(O)CC65C)C3(C)CO)C(O)C(O)C1O

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Identifiers

InChI

InChI=1S/C42H70O14/c1-20-28(48)33(56-35-31(51)30(50)29(49)24(17-43)54-35)32(52)36(53-20)55-27-9-10-38(4)25(39(27,5)18-44)8-11-40(6)34(38)23(46)14-21-22-15-37(2,3)12-13-42(22,19-45)26(47)16-41(21,40)7/h14,20,22-36,43-52H,8-13,15-19H2,1-7H3

0 references

InChIKey

WBZUTWKOBMHGCT-UHFFFAOYSA-N

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PubChem CID

73157132

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

WBZUTWKOBMHGCT-UHFFFAOYSA-N

(Q105301254)

2-[2-[[8,14-Dihydroxy-4,8a-bis(hydroxymethyl)-4,6a,6b,11,11,14b-hexamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,5-dihydroxy-6-methyloxan-4-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

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Identifiers

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