3alpha-hydroxyolean-11-en-28,13beta-olide (Q27137563)

CHEBI:69224 (English)

7 October 2016

chemical formula

C₃₀H₄₆O₃

1 reference

CHEBI:69224 (English)

7 October 2016

canonical SMILES

CC1(CCC23CCC4(C5(CCC6C(C(CCC6(C5C=CC4(C2C1)OC3=O)C)O)(C)C)C)C)C

1 reference

CHEBI:69224 (English)

7 October 2016

isomeric SMILES

C[C@]12CC[C@H](C([C@@H]1CC[C@@]3([C@@H]2C=C[C@@]45[C@]3(CC[C@@]6([C@H]4CC(CC6)(C)C)C(=O)O5)C)C)(C)C)O

1 reference

Oleanane-type triterpenoids from the leaves and twigs of Fatsia polycarpa.

CHEBI:69224 (English)

7 October 2016

2 references

stated in

Oleanane-type triterpenoids from the leaves and twigs of Fatsia polycarpa.

Mulguraea tridens

1 reference

stated in

Oleanane triterpenes from Junellia tridens.

Identifiers

InChI

InChI=1S/C30H46O3/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-19-25(3,4)22(31)10-11-26(19,5)20(27)9-13-30(28,21(29)18-24)33-23(29)32/h9,13,19-22,31H,8,10-12,14-18H2,1-7H3/t19-,20+,21+,22+,26-,27+,28-,29-,30-/m0/s1

1 reference

CHEBI:69224 (English)

VQUPEZXRIUOIJE-XDPQSBAJSA-N

7 October 2016

InChIKey

2 references

CHEBI:69224 (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

(3alpha)-3-Hydroxy-13,28-epoxyolean-11-en-28-one (English)

7 October 2016

2 references

CHEBI:69224 (English)

matched by identifier from

7 October 2016

InChIKey

VQUPEZXRIUOIJE-XDPQSBAJSA-N

Reaxys registry number

8739334

1 reference

3alpha-hydroxyolean-11-en-28,13beta-olide (English)

7 October 2016

ChEBI ID

69224

mapping relation type

2 references

3alpha-hydroxyolean-11-en-28,13beta-olide (English)

matched by identifier from

7 October 2016

International Chemical Identifier

InChI

InChI=1S/C30H46O3/c1-24(2)14-16-29-17-15-28(7)27(6)12-8-19-25(3,4)22(31)10-11-26(19,5)20(27)9-13-30(28,21(29)18-24)33-23(29)32/h9,13,19-22,31H,8,10-12,14-18H2,1-7H3/t19-,20+,21+,22+,26-,27+,28-,29-,30-/m0/s1

1 reference