(Q105346148)

English

10,11-Dihydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-2-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

group of stereoisomers with the chemical formula C₃₆H₅₈O₁₁

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Statements

instance of

group of stereoisomers

0 references

subclass of

oleanane triterpenoid

1 reference

inferred from

oleanane triterpenoid

mass

666.397912676 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₅₈O₁₁

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canonical SMILES

O=C(O)C12CCC(C)(COC3OC(CO)C(O)C(O)C3O)CC2C4=CCC5C6(C)CC(O)C(O)C(C)(CO)C6CCC5(C)C4(C)CC1

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found in taxon

Anchusa strigosa

1 reference

stated in

New Pyrrolizidine Alkaloids and Glycosides from Anchusa strigosa.

Identifiers

InChI

InChI=1S/C36H58O11/c1-31(18-46-29-27(42)26(41)25(40)22(16-37)47-29)10-12-36(30(44)45)13-11-34(4)19(20(36)14-31)6-7-24-32(2)15-21(39)28(43)33(3,17-38)23(32)8-9-35(24,34)5/h6,20-29,37-43H,7-18H2,1-5H3,(H,44,45)

0 references

InChIKey

YCAFVPUWJHSDEU-UHFFFAOYSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

YCAFVPUWJHSDEU-UHFFFAOYSA-N

(Q105346148)

10,11-Dihydroxy-9-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-2-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid

Statements

Identifiers

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