(Q105174960)

English

(1S,3R,5R,6R,9S,11R,14R,15S,18S,21R,22S,23R)-6,10,10,14,15,21,22-heptamethyl-2-oxahexacyclo[13.8.0.01,3.05,14.06,11.018,23]tricosane-9,18-diol

chemical compound

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Statements

instance of

type of chemical entity

0 references

subclass of

6,10,10,14,15,21,22-Heptamethyl-2-oxahexacyclo[13.8.0.01,3.05,14.06,11.018,23]tricosane-9,18-diol

1 reference

based on heuristic

inferred from SMILES

mass

444.360345396 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₂₉H₄₈O₃

0 references

canonical SMILES

OC1CCC2(C)C(CCC3(C)C2CC4OC45C6C(C)C(C)CCC6(O)CCC35C)C1(C)C

0 references

isomeric SMILES

C[C@H]1[C@H](C)CC[C@]2(O)CC[C@]3(C)[C@@]4(O[C@@H]4C[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@]43C)[C@H]12

0 references

found in taxon

Dracocephalum forrestii

1 reference

stated in

Three New Triterpenoids fromDracocephalum forrestii

Identifiers

InChI

InChI=1S/C29H48O3/c1-17-8-13-28(31)15-14-27(7)26(6)12-9-19-24(3,4)21(30)10-11-25(19,5)20(26)16-22-29(27,32-22)23(28)18(17)2/h17-23,30-31H,8-16H2,1-7H3/t17-,18+,19+,20-,21+,22-,23-,25+,26-,27+,28+,29+/m1/s1

0 references

InChIKey

MYJSQNXNKSUPEM-WBVZYPEHSA-N

0 references

2 references

17 September 2022

inferred from InChIKey

matched by identifier from

InChIKey

MYJSQNXNKSUPEM-WBVZYPEHSA-N

(Q105174960)

(1S,3R,5R,6R,9S,11R,14R,15S,18S,21R,22S,23R)-6,10,10,14,15,21,22-heptamethyl-2-oxahexacyclo[13.8.0.01,3.05,14.06,11.018,23]tricosane-9,18-diol

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Identifiers

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